Crystallography Open Database

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2312634 CIFC Cl2 SP 63/m5.961975; 5.961975; 6.304428
90; 90; 120
194.069Tambornino, Frank; Ringelband, Sven; Parker, Stewart F.; Howard, Christopher M.; Fortes, Dominic
A comprehensive characterization of thiophosgene in the solid state.
Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80
2312635 CIFC Cl2 SP 63/m5.964911; 5.964911; 6.317775
90; 90; 120
194.672Tambornino, Frank; Ringelband, Sven; Parker, Stewart F.; Howard, Christopher M.; Fortes, Dominic
A comprehensive characterization of thiophosgene in the solid state.
Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80
2312636 CIFC Cl2 SP 63/m5.967823; 5.967823; 6.331802
90; 90; 120
195.294Tambornino, Frank; Ringelband, Sven; Parker, Stewart F.; Howard, Christopher M.; Fortes, Dominic
A comprehensive characterization of thiophosgene in the solid state.
Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80
2312637 CIFC Cl2 SP 63/m5.970876; 5.970876; 6.346393
90; 90; 120
195.945Tambornino, Frank; Ringelband, Sven; Parker, Stewart F.; Howard, Christopher M.; Fortes, Dominic
A comprehensive characterization of thiophosgene in the solid state.
Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80
2312638 CIFC Cl2 SP 63/m5.973921; 5.973921; 6.361643
90; 90; 120
196.616Tambornino, Frank; Ringelband, Sven; Parker, Stewart F.; Howard, Christopher M.; Fortes, Dominic
A comprehensive characterization of thiophosgene in the solid state.
Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80
2312639 CIFC Cl2 SP 63/m5.977085; 5.977085; 6.377402
90; 90; 120
197.312Tambornino, Frank; Ringelband, Sven; Parker, Stewart F.; Howard, Christopher M.; Fortes, Dominic
A comprehensive characterization of thiophosgene in the solid state.
Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80
2312640 CIFC Cl2 SP 63/m5.98029; 5.98029; 6.393824
90; 90; 120
198.032Tambornino, Frank; Ringelband, Sven; Parker, Stewart F.; Howard, Christopher M.; Fortes, Dominic
A comprehensive characterization of thiophosgene in the solid state.
Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80
2312641 CIFC Cl2 SP 63/m5.983549; 5.983549; 6.410593
90; 90; 120
198.768Tambornino, Frank; Ringelband, Sven; Parker, Stewart F.; Howard, Christopher M.; Fortes, Dominic
A comprehensive characterization of thiophosgene in the solid state.
Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80
2312642 CIFC Cl2 SP 63/m5.986904; 5.986904; 6.42811
90; 90; 120
199.535Tambornino, Frank; Ringelband, Sven; Parker, Stewart F.; Howard, Christopher M.; Fortes, Dominic
A comprehensive characterization of thiophosgene in the solid state.
Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80
2312643 CIFC Cl2 SP 63/m5.990647; 5.990647; 6.446911
90; 90; 120
200.369Tambornino, Frank; Ringelband, Sven; Parker, Stewart F.; Howard, Christopher M.; Fortes, Dominic
A comprehensive characterization of thiophosgene in the solid state.
Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80
2312644 CIFC Cl2 SP 63/m5.994491; 5.994491; 6.46654
90; 90; 120
201.237Tambornino, Frank; Ringelband, Sven; Parker, Stewart F.; Howard, Christopher M.; Fortes, Dominic
A comprehensive characterization of thiophosgene in the solid state.
Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80
2312645 CIFC Cl2 SP 63/m5.998426; 5.998426; 6.487189
90; 90; 120
202.144Tambornino, Frank; Ringelband, Sven; Parker, Stewart F.; Howard, Christopher M.; Fortes, Dominic
A comprehensive characterization of thiophosgene in the solid state.
Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80
2312646 CIFC Cl2 SP 63/m6.0025; 6.0025; 6.50883
90; 90; 120
203.094Tambornino, Frank; Ringelband, Sven; Parker, Stewart F.; Howard, Christopher M.; Fortes, Dominic
A comprehensive characterization of thiophosgene in the solid state.
Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80
2312647 CIFC Cl2 SP 63/m6.006775; 6.006775; 6.53172
90; 90; 120
204.099Tambornino, Frank; Ringelband, Sven; Parker, Stewart F.; Howard, Christopher M.; Fortes, Dominic
A comprehensive characterization of thiophosgene in the solid state.
Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80
2312648 CIFC Cl2 SP 63/m6.011293; 6.011293; 6.55562
90; 90; 120
205.154Tambornino, Frank; Ringelband, Sven; Parker, Stewart F.; Howard, Christopher M.; Fortes, Dominic
A comprehensive characterization of thiophosgene in the solid state.
Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80
2312665 CIF
HKL
Paper
C10 H2 K2 N10 O4C 1 2/c 134.434; 3.41097; 28.253
90; 126.49; 90
2667.9Gaydamaka, A. A.; Rashchenko, S. V.
Crystal structure of the incommensurate modulated high-pressure phase of the potassium guaninate monohydrate.
Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80
5000003 CIFC4 H10 N2 O4P 21 21 215.593; 9.827; 11.808
90; 90; 90
649Verbist, J. J.; Lehmann, M. S.; Koetzle, T. F.; Hamilton, W. C.
Precision neutron diffraction structure determination of protein and nucleic acid components. VI. The crystal and molecular structure of the amino acid L-asparagine monohydrate
Acta Crystallographica Section B, 1972, 28, 3006-3013
5000004 CIFC4 H7 N O4P 1 21 17.617; 6.982; 5.142
90; 99.84; 90
269.44Derissen, J. L.; Endeman, H. J.; Peerdeman, A. F.
The crystal and molecular structure of L-aspartic acid
Acta Crystallographica Section B, 1968, 24, 1349-1354
5000006 CIFC5 H10 N2 O3P 21 21 2116.02; 7.762; 5.119
90; 90; 90
636.53Koetzle, T. F.; Frey, M. N.; Lehmann, M. S.; Hamilton, W. C.
Precision neutron diffraction structure determination of protein and nucleic acid components. XIII. Molecular and crystal structure of the amino acid L-glutamine
Acta Crystallographica Section B, 1973, 29, 2571-2575
5000007 CIF
Paper
C5 H10 Cl N O4P 21 21 215.151; 11.789; 13.347
90; 90; 90
810.5Sequeira, A.; Rajagopal, H.; Chidambaram, R.
A neutron diffraction study of the structure of L-glutamic acid.HCl
Acta Crystallographica Section B, 1972, 28, 2514-2519
5000009 CIFC6 H9 N3 O2P 1 21 15.172; 7.384; 9.474
90; 97.162; 90
358.99Madden, J. J.; McGandy, E. L.; Seeman, N. C.; Harding, M. M.; Hoy, A.
The crystal structure of the monoclinic form of L-histidine
Acta Crystallographica Section B, 1972, 28, 2382-2389
5000011 CIFC6 H19 Cl N2 O4P 1 21 17.492; 13.32; 5.879
90; 97.79; 90
581.27Koetzle, T. F.; Lehmann, M. S.; Verbist, J. J.; Hamilton, W. C.
Precision neutron diffraction structure determination of protein and nucleic acid components. VII. The crystal and molecular structure of the amino acid L-lysine monohydrochloride dihydrate
Acta Crystallographica Section B, 1972, 28, 3207-3214
5000013 CIFC9 H12 Cl N O2P 21 21 2127.763; 7.059; 5.38
90; 90; 90
1054.37Al-Karaghouli, A. R.; Koetzle, T. F.
Neutron diffraction study of L-phenylalanine hydrochloride
Acta Crystallographica Section B, 1975, 31, 2461-2465
5000015 CIFC3 H7 N O3P 21 21 218.599; 9.348; 5.618
90; 90; 90
451.59Kistenmacher, T. J.; Rand, G. A.; Marsh, R. E.
Refinements of the crystal structures of DL-serine and anhydrous L-serine
Acta Crystallographica Section B, 1974, 30, 2573-2578
5000018 CIFC10 H13 N5 O4P 1 21 14.825; 10.282; 11.823
90; 99.3; 90
578.84Lai, T. F.; Marsh, R. E.
The crystal structure of adenosine
Acta Crystallographica Section B, 1972, 28, 1982-1989
5000020 CIFC10 H17 N5 O7P 1 21 117.518; 11.502; 6.658
90; 98.17; 90
1327.92Thewalt, U.; Bugg, C. E.; Marsh, R. E.
The crystal structure of guanosine dihydrate and inosine dihydrate
Acta Crystallographica Section B, 1970, 26, 1089-1101
5000021 CIFC10 H14 N2 O5P 21 21 214.86; 13.91; 16.32
90; 90; 90
1103.27Young, D. W.; Tollin, P.; Wilson, H. R.
The crystal and molecular structure of thymidine
Acta Crystallographica Section B, 1969, 25, 1423-1432
5000022 CIFC12 H18 N2 O10P 1 21 111.159; 14.461; 4.821
90; 101.15; 90
763.28Morikawa, K.; Torii, K.; Iitaka, Y.; Tsuboi, M.
Uridine-5-oxyacetic acid methyl ester monohydrate
Acta Crystallographica Section B, 1975, 31, 1004-1007
5000023 CIFC12 H8 Cl2P 1 21/n 115.78; 13.74; 9.682
90; 96.23; 90
2086.83Brock, C. P.; Kuo, M. S.; Levy, H. A.
4,4'-Dichlorobiphenyl: crystal packing in para-substituted biphenyls
Acta Crystallographica Section B, 1978, 34, 981-985
5000024 CIFC12 Cl10P b c n13.372; 10.497; 11.992
90; 90; 90
1683.27Pedersen, B.
Decachlorobiphenyl, C~12~Cl~10~: the crystal and molecular structure
Acta Crystallographica Section B, 1975, 31, 2931-2933
5000031 CIFC18 H25 O2.499P 21 21 212.055; 19.28; 6.63
90; 90; 90
1540.95Busetta, B.; Hospital, M.
Structure cristalline et moleculaire de l'oestradiol hemihydrate
Acta Crystallographica Section B, 1972, 28, 560-567
5000032 CIFC18 H22 O2P 21 21 2110.043; 18.424; 7.787
90; 90; 90
1440.85Busetta, B.; Courseille, C.; Hospital, M.
Structure cristallines et moleculaires de trois formes polymorphes de l'oestrone
Acta Crystallographica Section B, 1973, 29, 298-313
5000038 CIFO2 ZrF m -3 m5.1291; 5.1291; 5.1291
90; 90; 90
134.9Martin, U; Boysen, H; Frey, F
Neutron powder investigation of tetragonal and cubic stabilized zirconia, TZP and CSZ, at temperatures up to 1400 K
Acta Crystallographica Section B, 1993, 49, 403-413
5000063 CIFC6 H8 O7P 1 21/a 112.817; 5.628; 11.465
90; 111.22; 90
770.94Glusker, J. P.; Minkin, J. A.; Patterson, A. L.
X-ray crystal analysis of the substrates of aconitase. IX. A refinement of the structure of anhydrous citric acid
Acta Crystallographica Section B, 1969, 25, 1066-1072
5000065 CIFC6 H12 O6P 21 21 218.088; 9.204; 10.034
90; 90; 90
746.95Kanters, J. A.; Roelofsen, G.; Alblas, B. P.; Meinders, I.
The crystal and molecular structure of β-d-fructose, with emphasis on anomeric effect and hydrogen-bond interactions
Acta Crystallographica Section B, 1977, 33, 665-672
5000078 CIFC4 H3 F N2 O2P -19.22; 12.66; 12.67
89.7; 43.9; 98.6
1000.08Fallon, III, L.
The crystal and molecular structure of 5-fluorouracil
Acta Crystallographica Section B, 1973, 29, 2549-2556
5000084 CIFC22 H29 F O4P 21 21 2111.319; 22.803; 7.381
90; 90; 90
1905.09Dupont, L.; Dideberg, O.; Campsteyn, H.
Structure cristalline de la l7-désoxyméthasone, C~22~H~29~O~4~F
Acta Crystallographica Section B, 1974, 30, 514-516
5000102 CIFC17 H19 N O3P 1 21/n 18.743; 13.364; 13.147
90; 108.66; 90
1455.37Grynpas, M.; Lindley, P. F.
The crystal and molecular structure of 1-piperoylpiperidine
Acta Crystallographica Section B, 1975, 31, 2663-2667
5000111 CIFC27 H46 OP 114.172; 34.209; 10.481
94.64; 90.67; 96.32
5032.77Shieh, H.-S.; Hoard, L. G.; Nordman, C. E.
The structure of cholesterol
Acta Crystallographica Section B, 1981, 37, 1538-1543
5000131 CIFC5 H6 N4 O SC 1 2/c 115.294; 7.732; 12.379
90; 101.64; 90
1433.75Sletten, E.; Sletten, J.; Jensen, L. H.
The crystal and molecular structure of 6-mercaptopurine monohydrate
Acta Crystallographica Section B, 1969, 25, 1330-1338
5000140 CIFC6 H2 Cl N3 O6P 1 21/a 111.02; 6.795; 14.964
90; 124.15; 90
927.31Willis, J. S.; Stewart, J. M.; Ammon, H. L.; Preston, H. S.; Gluyas, R. E.; Harris, P. M.
The crystal structure of picryl chloride
Acta Crystallographica Section B, 1971, 27, 786-793
5000142 CIFC6 H4 N2 O5P 21 21 216.106; 23.24; 5.168
90; 90; 90
733.36Kagawa, T.; Kawai, R.; Kashino, S.; Haisa, M.
The crystal and molecular structure of 2,4-dinitrophenol
Acta Crystallographica Section B, 1976, 32, 3171-3175
5000144 CIFC H4 N4 O2F d d 217.6152; 24.8502; 3.588
90; 90; 90
1570.62Choi, C. S.
Refinement of 2-nitroguanidine by neutron powder diffraction
Acta Crystallographica Section B, 1981, 37, 1955-1957
5000148 CIFC3 H6 N6 O6P b c a13.182; 11.574; 10.709
90; 90; 90
1633.86Choi, C. S.; Prince, E.
The crystal structure of cyclotrimethylenetrinitramine
Acta Crystallographica Section B, 1972, 28, 2857-2862
5000150 CIFC6 H3 N3 O6P b c a9.78; 26.94; 12.82
90; 90; 90
3377.73Choi, C. S.; Abel, J. E.
The crystal structure of 1,3,5-trinitrobenzene by neutron diffraction
Acta Crystallographica Section B, 1972, 28, 193-201
5000151 CIFC6 H4.339 N3 O8.669P -3 c 112.6077; 12.6077; 10.1147
90; 90; 120
1392.37Pierce-Butler, M.
Structures of 2,4,6-trinitro-1.3-benzenediol 2/3-hydrate and 2,4,6-trinitro-1,3,5-benzenetriol 2/3-hydrate
Acta Crystallographica Section B, 1982, 38, 3097-3100
5000152 CIFC H5 N3 O4P 1 21/c 19.543; 8.201; 7.498
90; 124.25; 90
485.05Worsham, Jr, J. E.; Busing, W. R.
The crystal structure of uronium nitrate (urea nitrate) by neutron diffraction
Acta Crystallographica Section B, 1969, 25, 572-578
5000153 CIFC H6 N4 SP 1 21/c 14.74; 15.53; 7.19
90; 122.4; 90
446.88Braibanti, A.; Tiripicchio, A.; Camellini, M. T.
Crystal and molecular structure of thiocarbohydrazide
Acta Crystallographica Section B, 1969, 25, 2286-2290
5000154 CIFC5 H8 N4 O12P c n b13.29; 13.49; 6.83
90; 90; 90
1224.5Cady, H. H.; Larson, A. C.
Pentaerythritol tetranitrate II: its crystal structure and transformation to PETN I; an algorithm for refinement of crystal structures with poor data
Acta Crystallographica Section B, 1975, 31, 1864-1869
5000158 CIFC12 H22 O4P 1 21/c 113.105; 4.921; 10.183
90; 97.4; 90
651.23Vanier, M.; Brisse, F.
Nouvel affinement de la structure de l'acide dodécanedioïque
Acta Crystallographica Section B, 1982, 38, 643-645
5000165 CIFC15 H13 N OC 1 c 116.77; 4.83; 15.85
90; 115.4; 90
1159.73Haisa, M.; Kashino, S.; Ueno, T.; Shinozaki, N.; Matsuzaki, Y.
The structures of N-aromatic amides: p-acetanisidide, N-2-naphthylacetamide and N-2-fluorenylacetamide
Acta Crystallographica Section B, 1980, 36, 2306-2311
5000166 CIFC8 H8 OP 1 21/n 110.256; 8.678; 8.558
90; 121; 90
652.88Tanimoto, Y.; Kobayashi, H.; Nagakura, S.; Saito, Y.
The crystal structure of acetophenone at 154 K
Acta Crystallographica Section B, 1973, 29, 1822-1826
5000168 CIFC14 H10P 1 21/a 18.5526; 6.0158; 11.172
90; 124.596; 90
473.168Brock, C. P.; Dunitz, J. D.
Temperature dependence of thermal motion in crystalline anthracene
Acta Crystallographica Section B, 1990, 46, 795-806
5000169 CIFC6 H11 N OC 1 2/c 119.28; 7.78; 9.57
90; 112.39; 90
1327.27Winkler, F. K.; Dunitz, J. D.
Medium-ring compounds. XIX. Caprolactam: structure refinement
Acta Crystallographica Section B, 1975, 31, 268-269
5000173 CIFC7 H8 OP 1 21/c 15.7; 11.71; 18.13
90; 99.07; 90
1194.99Bois, C.
Structure du p-crésol à basse témperature
Acta Crystallographica Section B, 1970, 26, 2086-2092
5000181 CIFC14 H10P 1 21 18.441; 6.14; 9.438
90; 97.96; 90
484.44Petricek, V.; Cisarova, I.; Hummel, L.; Kroupa, J.; Brezina, B.
Orientational disorder in phenanthrene. Structure determination at 248, 295, 339 and 344 K
Acta Crystallographica Section B, 1990, 46, 830-832
5000183 CIFC H4 N2 SP b n m5.488; 7.663; 8.564
90; 90; 90
360.16Takahashi, I.; Onodera, A.; Shiozaki, Y.
Structural changes of thiourea in connection with its phase transitions: reappraisal of rigidity and libration of the molecule
Acta Crystallographica Section B, 1990, 46, 661-664
5000192 CIFC11 H23 Br OP 1 21 147.1; 5.26; 31.14
90; 132.9; 90
5651.43Rosen, L. S.; Hybl, A.
The crystal structure of 11-bromoundecanol
Acta Crystallographica Section B, 1972, 28, 610-617
5910043 CIF
Paper
C4 H7 N3 O2P 1 21/c 17.728; 9.817; 7.52
90; 100.5; 90
561M. Eisenstein
Static deformation densities for cytosine and adenine
Acta Crystallographica Section B, 1988, 44, 412-426
5910086 CIFK2 O13 W4P -315.566; 15.566; 3.746
90; 90; 120
786.1Okada, K.; Marumo, F.; Iwai, S. I.
The crystal structure of K2 W4 O13
Acta Crystallographica B (24,1968-38,1982), 1978, 34, 3193-3195
5910115 CIF
Paper
C2 H6 OP 1 c 15.377; 6.882; 8.255
90; 102.2; 90
298.6P.-G. Jönsson
Hydrogen bond studies. CXIII. The crystal structure of ethanol at 87 K
Acta Crystallogr.,Sect.B:Struct.Crystallogr.Cryst.Chem., 1976, 32, 232-235
6000092 CIFCo O6 Pb2 WI2/m7.9602; 5.6779; 5.6967
90; 90.047; 90
257.47Baldinozzi, G.; Calvarin, G.; Sciau, P.; Grebille, D.; Suard, E.
Neutron Rietveld refinement of the incommensurate phase of the ordered perovskite Pb2CoWO6
Acta Crystallographica B, 2000, 56, 570-576
6000193 CIF
Paper
C13 H36 Si4F m -3 m12.8902; 12.8902; 12.8902
90; 90; 90
2141.8Dinnebier, Robert E.; Dollase, Wayne A.; Helluy, Xavier; Kümmerlen, Jörg; Sebald, Angelika; Schmidt, Martin U.; Pagola, Silvina; Stephens, Peter W.; van Smaalen, Sander
Order‒disorder phenomena determined by high-resolution powder diffraction: the structures of tetrakis(trimethylsilyl)methane C[Si(CH~3~)~3~]~4~ and tetrakis(trimethylsilyl)silane Si[Si(CH~3~)~3~]~4~
Acta Crystallographica Section B, 1999, 55, 1014-1029
6000194 CIF
Paper
C12 H36 Si5F m -3 m13.5218; 13.5218; 13.5218
90; 90; 90
2472.31Dinnebier, Robert E.; Dollase, Wayne A.; Helluy, Xavier; Kümmerlen, Jörg; Sebald, Angelika; Schmidt, Martin U.; Pagola, Silvina; Stephens, Peter W.; van Smaalen, Sander
Order‒disorder phenomena determined by high-resolution powder diffraction: the structures of tetrakis(trimethylsilyl)methane C[Si(CH~3~)~3~]~4~ and tetrakis(trimethylsilyl)silane Si[Si(CH~3~)~3~]~4~
Acta Crystallographica Section B, 1999, 55, 1014-1029
6000195 CIF
Paper
C12 H36 Si5P 21 313.17158; 13.17158; 13.17158
90; 90; 90
2285.14Dinnebier, Robert E.; Dollase, Wayne A.; Helluy, Xavier; Kümmerlen, Jörg; Sebald, Angelika; Schmidt, Martin U.; Pagola, Silvina; Stephens, Peter W.; van Smaalen, Sander
Order‒disorder phenomena determined by high-resolution powder diffraction: the structures of tetrakis(trimethylsilyl)methane C[Si(CH~3~)~3~]~4~ and tetrakis(trimethylsilyl)silane Si[Si(CH~3~)~3~]~4~
Acta Crystallographica Section B, 1999, 55, 1014-1029
6000196 CIF
Paper
C13 H36 Si4P 21 312.609; 12.609; 12.609
90; 90; 90
2004.7Dinnebier, Robert E.; Dollase, Wayne A.; Helluy, Xavier; Kümmerlen, Jörg; Sebald, Angelika; Schmidt, Martin U.; Pagola, Silvina; Stephens, Peter W.; van Smaalen, Sander
Order‒disorder phenomena determined by high-resolution powder diffraction: the structures of tetrakis(trimethylsilyl)methane C[Si(CH~3~)~3~]~4~ and tetrakis(trimethylsilyl)silane Si[Si(CH~3~)~3~]~4~
Acta Crystallographica Section B, 1999, 55, 1014-1029
6000197 CIF
Paper
C13 H36 Si4P a -312.7876; 12.7876; 12.7876
90; 90; 90
2091.06Dinnebier, Robert E.; Dollase, Wayne A.; Helluy, Xavier; Kümmerlen, Jörg; Sebald, Angelika; Schmidt, Martin U.; Pagola, Silvina; Stephens, Peter W.; van Smaalen, Sander
Order‒disorder phenomena determined by high-resolution powder diffraction: the structures of tetrakis(trimethylsilyl)methane C[Si(CH~3~)~3~]~4~ and tetrakis(trimethylsilyl)silane Si[Si(CH~3~)~3~]~4~
Acta Crystallographica Section B, 1999, 55, 1014-1029
6000198 CIF
Paper
C15 H25 N O2 SP 1 21/c 116.96; 8.1382; 11.781
90; 104.777; 90
1572.28Tremayne, Maryjane; MacLean, Elizabeth J.; Tang, Chiu C.; Glidewell, Christopher
2,4,6-Triisopropylbenzenesulfonamide: Monte Carlo structure solution from X-ray powder diffraction data for a molecular system containing four independent asymmetric rotors
Acta Crystallographica Section B, 1999, 55, 1068-1074
6000447 CIFC8 H24 N2 O4 SF11.026; 11.026; 11.026
90; 90; 90
1340.46Malchus, M.; Jansen, M.
Structural investigations of the phase transitions of tetramethylammonium sulfate
Acta Crystallographica B, 1998, 54, 494-502
6000571 CIFCs D O4 SP 1 21/c 17.7801; 8.1392; 7.7219
90; 110.872; 90
456.89Belushkin, A. V.; David, W. I. F.; Ibberson, R. M.; Shuvalov, L. A.
High-resolution neutron powder diffraction studies of the structure of CsDSO4
Acta Crystallographica B, 1991, 47, 161-166
6000576 CIFC D6 I NP b m a7.1743; 7.0967; 8.8323
90; 90; 90
449.69Yamamuro, O.; Matsuo, T.; Suga, H.; David, W. I. F.; Ibberson, R. M.; Leadbetter, A. J.
Neutron-diffraction and calorimetric studies of methylammonium iodide
Acta Crystallographica B, 1992, 48, 329-336
9007500 CIFAg3 As S3C 1 2/c 112; 6.26; 17.08
90; 110; 90
1205.67Engel, P.; Nowacki, W.
Die kristallstruktur von Ag3AsS3
Acta Crystallographica, Section B, 1968, 24, 77-81
9007501 CIFCu H6 O7 SC 1 c 15.592; 13.029; 7.341
90; 97.05; 90
530.808Zahrobsky, R. F.; Baur, W. H.
On the crystal chemistry of salt hydrates. V. The determination of the crystal structure of CuSO4*3H2O (bonattite) Locality: synthetic
Acta Crystallographica, Section B, 1968, 24, 508-513
9007502 CIFFe1.08 H11.25 Mg0.2 Mn0.25 O16 S2 Zn0.47P 1 21/n 110.526; 17.872; 7.136
90; 100.13; 90
1321.5Susse P
Die kristallstruktur des botryogens Locality: Rammelsberg mine near Goslar, Germany
Acta Crystallographica, Section B, 1968, 24, 760-767
9007503 CIFAl4.3 As0.905 Ca0.47 Cu0.06 Fe0.2 H4 Mg Mn3.53 O28 Si5 V0.095P n m m :28.7126; 5.8108; 18.5214
90; 90; 90
937.686Donnay G; Allmann R
Si3O10 groups in the crystal structure of ardennite
Acta Crystallographica, Section B, 1968, 24, 845-855
9007504 CIFAs2 H8 O9P 1 21/c 17.6; 13.29; 8.24
90; 109.6; 90
784.049Worzala, H.
Die kristallstruktur des arsensaurehydrates 2H3AsO4.H2O
Acta Crystallographica, Section B, 1968, 24, 987-991
9007505 CIFCa Cu2.64 H12 O17 S2 Zn1.36C 1 2/c 122.186; 6.25; 21.853
90; 113.36; 90
2781.81Sabelli, C.; Zanazzi, P. F.
The crystal structure of serpierite
Acta Crystallographica, Section B, 1968, 24, 1214-1221
9007506 CIFAl3 B Fe0.1 Mg0.9 O9 SiP b n m10.335; 10.978; 5.76
90; 90; 90
653.516Stephenson, D. A.; Moore, P. B.
The crystal structure of grandidierite, (Mg,Fe)Al3SiBO9
Acta Crystallographica, Section B, 1968, 24, 1518-1522
9007507 CIFB F4 NaC m c m6.8368; 6.2619; 6.7916
90; 90; 90
290.758Brunton, G.
Refinement of the structure of NaBF4
Acta Crystallographica, Section B, 1968, 24, 1703-1704
9007508 CIFB F4 KP n m a8.6588; 5.48; 7.0299
90; 90; 90
333.57Brunton, G.
The crystal structure of KBF4
Acta Crystallographica, Section B, 1969, 25, 2161-2162
9007509 CIFAl2.71 Ca1.9 Fe0.15 H3 Mg0.45 O14 Si2.79A 1 2/m 18.83; 5.9; 19.17
90; 97.12; 90
990.998Galli, E.; Alberti, A.
On the crystal structure of pumpellyite
Acta Crystallographica, Section B, 1969, 25, 2276-2281
9007510 CIFAg5 S4 SbC m c 217.873; 12.467; 8.583
90; 90; 90
842.445Ribar, B.; Nowacki, W.
Die kristallstruktur von stephanit, [SbS3|S|Ag5]
Acta Crystallographica, Section B, 1970, 26, 201-207
9007511 CIFAs2 Ca2 H2 O8P -17.0591; 6.8906; 7.2006
97.43; 103.55; 87.75
337.625Ferraris, G.; Chiari, G.
The crystal structure of CaHAsO4 (weilite)
Acta Crystallographica, Section B, 1970, 26, 403-409
9007512 CIFCa2 H4 Mn O10 P2P -15.79; 6.57; 5.51
102.27; 108.67; 90.3
193.428Fanfani, L.; Nunzi, A.; Zanazzi, P. F.
The crystal structure of fairfieldite
Acta Crystallographica, Section B, 1970, 26, 640-645
9007513 CIFAl H3 O3P -15.114; 5.082; 5.127
70.27; 74; 58.47
106.089Bosmans, H. J.
Unit cell and crystal structure of nordstrandite, Al(OH)3
Acta Crystallographica, Section B, 1970, 26, 649-652
9007514 CIFCu7 S4P n m a7.89; 7.84; 11.01
90; 90; 90
681.052Koto, K.; Morimoto, N.
The crystal structure of anilite
Acta Crystallographica, Section B, 1970, 26, 915-924
9007515 CIFAs H15 Na2 O11P 1 21/n 19.401; 11.025; 10.674
90; 95.5; 90
1101.22Baur, W. H.; Khan, A. A.
On the crystal chemistry of salt hydrates. VI. The crystal structures of disodium hydrogen orthoarsenate heptahydrate and of disodium hydrogen orthophosphate heptahydrate
Acta Crystallographica, Section B, 1970, 26, 1584-1596
9007516 CIFH15 Na2 O11 PP 1 21/n 19.258; 11.007; 10.437
90; 95.61; 90
1058.47Baur, W. H.; Khan, A. A.
On the crystal chemistry of salt hydrates. VI. The crystal structures of disodium hydrogen orthoarsenate heptahydrate and of disodium hydrogen orthophosphate heptahydrate
Acta Crystallographica, Section B, 1970, 26, 1584-1596
9007517 CIFAs Cu3 S4P m n 217.407; 6.436; 6.154
90; 90; 90
293.37Adiwidjaja, G.; Lohn, J.
Strukturverfeinerung von enargit, Cu3AsS4
Acta Crystallographica, Section B, 1970, 26, 1878-1879
9007518 CIFAs Ca H5 O6I 1 a 15.9745; 15.434; 6.2797
90; 114.83; 90
525.525Ferraris, G.; Jones, D. W.; Yerkess, J.
Determination of hydrogen atom positions in the crystal structure of pharmacolite, CaHAsO4(H2O)2, by neutron diffraction
Acta Crystallographica, Section B, 1971, 27, 349-354
9007519 CIFC11 H10 O2 SP 21 21 2118.331; 9.012; 5.949
90; 90; 90
982.769Christensen, A. T.; Thom, E.
The crystal structure of 2-dimenthylsulfuranylidene-1,3-indanedione
Acta Crystallographica, Section B, 1971, 27, 581-586
9007520 CIFMn2 O3P c a b9.4157; 9.4233; 9.4047
90; 90; 90
834.45Geller, S.
Structures of alpha-Mn203, (MnO.983Fe0.017)203 and (Mn0.37Fe0.63)2O3 and relation to magnetic ordering
Acta Crystallographica, Section B, 1971, 27, 821-828
9007521 CIFFe0.034 Mn1.966 O3I a -39.4146; 9.4146; 9.4146
90; 90; 90
834.46Geller, S.
Structures of alpha-Mn203, (MnO.983Fe0.017)203 and (Mn0.37Fe0.63)2O3 and relation to magnetic ordering Sample: (MnO.983Fe0.017)203
Acta Crystallographica, Section B, 1971, 27, 821-828
9007522 CIFFe1.26 Mn0.74 O3I a -39.4126; 9.4126; 9.4126
90; 90; 90
833.928Geller, S.
Structures of alpha-Mn203, (MnO.983Fe0.017)203 and (Mn0.37Fe0.63)2O3 and relation to magnetic ordering Sample: (Mn0.37Fe0.63)2O3
Acta Crystallographica, Section B, 1971, 27, 821-828
9007523 CIFC2 H5 N OR 3 c :H11.526; 11.526; 13.589
90; 90; 120
1563.42Denne, W. A.; Small, R. W. H.
A refinement of the structure of rhombohedral acetamide
Acta Crystallographica, Section B, 1971, 27, 1094-1098
9007524 CIFBi Cu Pb S3P n m a11.608; 4.0279; 11.275
90; 90; 90
527.172Kohatsu, I.; Wuensch, B. J.
The crystal structure of aikinite, PbCuBiS3 Note: B(3,3) altered for Pb and Cu, in order to reproduce Biso
Acta Crystallographica, Section B, 1971, 27, 1245-1252
9007525 CIFAl0.089 Ca3.368 Ce1.048 F3 Fe0.212 K0.064 Na2.178 Nb0.327 O15 Si4 Ti0.515 Zr0.069P 1 21/c 17.437; 5.664; 18.843
90; 101.38; 90
778.122Galli, E.; Alberti, A.
The crystal structure of rinkite
Acta Crystallographica, Section B, 1971, 27, 1277-1284
9007526 CIFO4 Si Zn2I -4 2 d7.0069; 7.0069; 6.4637
90; 90; 90
317.346Marumo, F.; Syono, Y.
The crystal structure of Zn2SiO4-II, a high-pressure phase of willemite
Acta Crystallographica, Section B, 1971, 27, 1868-1870
9007527 CIFH15.479 Na6.335 O32.335 P2P -3 c 111.89; 11.89; 12.671
90; 90; 120
1551.33Tillmanns, E.; Baur, W. H.
On the crystal chemistry of salt hydrates. VII. The crystal structures of pseudo trisodium orthoarsenate dodecahydrate and the isomorphous phosphate and vanadate salts
Acta Crystallographica, Section B, 1971, 27, 2124-2132
9007528 CIFH15.454 Na6.31 O32.31 V2P -3 c 112.038; 12.038; 12.833
90; 90; 120
1610.53Tillmanns, E.; Baur, W. H.
On the crystal chemistry of salt hydrates. VII. The crystal structures of pseudo trisodium orthoarsenate dodecahydrate and the isomorphous phosphate and vanadate salts
Acta Crystallographica, Section B, 1971, 27, 2124-2132
9007529 CIFAs2 H15.404 Na6.26 O32.26P -3 c 112.017; 12.017; 12.783
90; 90; 120
1598.66Tillmanns, E.; Baur, W. H.
On the crystal chemistry of salt hydrates. VII. The crystal structures of pseudo trisodium orthoarsenate dodecahydrate and the isomorphous phosphate and vanadate salts
Acta Crystallographica, Section B, 1971, 27, 2124-2132
9007530 CIFO2 SiP 42/m n m4.179; 4.179; 2.6649
90; 90; 90
46.54Baur, W. H.; Khan, A. A.
Rutile-type compounds. IV. SiO2, GeO2 and a comparison with other rutile-type structures
Acta Crystallographica, Section B, 1971, 27, 2133-2139
9007531 CIFO2 TiP 42/m n m4.5941; 4.5941; 2.9589
90; 90; 90
62.45Baur, W. H.; Khan, A. A.
Rutile-type compounds. IV. SiO2, GeO2 and a comparison with other rutile-type structures
Acta Crystallographica, Section B, 1971, 27, 2133-2139
9007532 CIFGe O2P 42/m n m4.3975; 4.3975; 2.8625
90; 90; 90
55.355Baur, W. H.; Khan, A. A.
Rutile-type compounds. IV. SiO2, GeO2 and a comparison with other rutile-type structures
Acta Crystallographica, Section B, 1971, 27, 2133-2139
9007533 CIFO2 SnP 42/m n m4.738; 4.738; 3.1865
90; 90; 90
71.533Baur, W. H.; Khan, A. A.
Rutile-type compounds. IV. SiO2, GeO2 and a comparison with other rutile-type structures
Acta Crystallographica, Section B, 1971, 27, 2133-2139
9007534 CIFF2 MgP 42/m n m4.6213; 4.6213; 3.0159
90; 90; 90
64.409Baur, W. H.; Khan, A. A.
Rutile-type compounds. IV. SiO2, GeO2 and a comparison with other rutile-type structures
Acta Crystallographica, Section B, 1971, 27, 2133-2139
9007535 CIFF2 MnP 42/m n m4.8738; 4.8738; 3.3107
90; 90; 90
78.642Baur, W. H.; Khan, A. A.
Rutile-type compounds. IV. SiO2, GeO2 and a comparison with other rutile-type structures
Acta Crystallographica, Section B, 1971, 27, 2133-2139
9007536 CIFF2 FeP 42/m n m4.6945; 4.6945; 3.3097
90; 90; 90
72.94Baur, W. H.; Khan, A. A.
Rutile-type compounds. IV. SiO2, GeO2 and a comparison with other rutile-type structures
Acta Crystallographica, Section B, 1971, 27, 2133-2139
9007537 CIFCo F2P 42/m n m4.6954; 4.6954; 3.1774
90; 90; 90
70.051Baur, W. H.; Khan, A. A.
Rutile-type compounds. IV. SiO2, GeO2 and a comparison with other rutile-type structures
Acta Crystallographica, Section B, 1971, 27, 2133-2139
9007538 CIFF2 NiP 42/m n m4.6498; 4.6498; 3.0838
90; 90; 90
66.674Baur, W. H.; Khan, A. A.
Rutile-type compounds. IV. SiO2, GeO2 and a comparison with other rutile-type structures
Acta Crystallographica, Section B, 1971, 27, 2133-2139
9007539 CIFF2 ZnP 42/m n m4.7048; 4.7048; 3.1338
90; 90; 90
69.367Baur, W. H.; Khan, A. A.
Rutile-type compounds. IV. SiO2, GeO2 and a comparison with other rutile-type structures
Acta Crystallographica, Section B, 1971, 27, 2133-2139
9007540 CIFCr O2P 42/m n m4.421; 4.421; 2.917
90; 90; 90
57.013Baur, W. H.; Khan, A. A.
Rutile-type compounds. IV. SiO2, GeO2 and a comparison with other rutile-type structures Note: data from Cloud et al (1962)
Acta Crystallographica, Section B, 1971, 27, 2133-2139
9007541 CIFO2 RuP 42/m n m4.4919; 4.4919; 3.1066
90; 90; 90
62.682Baur, W. H.; Khan, A. A.
Rutile-type compounds. IV. SiO2, GeO2 and a comparison with other rutile-type structures Note: data from Boman (1970)
Acta Crystallographica, Section B, 1971, 27, 2133-2139
9007542 CIFO2 OsP 42/m n m4.5003; 4.5003; 3.1839
90; 90; 90
64.483Baur, W. H.; Khan, A. A.
Rutile-type compounds. IV. SiO2, GeO2 and a comparison with other rutile-type structures Note: data from Boman (1970)
Acta Crystallographica, Section B, 1971, 27, 2133-2139
9007543 CIFO2 PbP 42/m n m4.9568; 4.9568; 3.3866
90; 90; 90
83.208Baur, W. H.; Khan, A. A.
Rutile-type compounds. IV. SiO2, GeO2 and a comparison with other rutile-type structures Note: data from Leciejewicz and Padlo (1962)
Acta Crystallographica, Section B, 1971, 27, 2133-2139
9007544 CIFAs3 Co0.87 Fe0.11 Ni0.13I m -38.195; 8.195; 8.195
90; 90; 90
550.36Mandel, N.; Donohue, J.
The refinement of the crystal structure of skutterudite, CoAs3
Acta Crystallographica, Section B, 1971, 27, 2288-2289
9007545 CIFAs Ca H3 O5P c n b6.904; 16.161; 7.935
90; 90; 90
885.352Ferraris, G.; Jones, D. W.; Yerkess, J.
A neutron and X-ray refinement of the crystal structure of CaHAsO4*H2O (haidingerite) Sample: neutron refinement Locality: synthetic
Acta Crystallographica, Section B, 1972, 28, 209-214
9007546 CIFAs Ca H2 O5P c n b6.904; 16.161; 7.935
90; 90; 90
885.352Ferraris, G.; Jones, D. W.; Yerkess, J.
A neutron and X-ray refinement of the crystal structure of CaHAsO4*H2O (haidingerite) Sample: X-ray refinement Locality: synthetic
Acta Crystallographica, Section B, 1972, 28, 209-214
9007547 CIFCr H4 N Na O6P 21 21 218.413; 13.039; 6.219
90; 90; 90
682.206Khan, A. A.; Baur, W. H.
Salt hydrates. VIII. The crystal structures of sodium ammonium orthochromate dihydrate and magnesium diammonium bis(hydrogen orthophosphate) tetrahydrate and a discussion of the ammonium ion
Acta Crystallographica, Section B, 1972, 28, 683-693
9007548 CIFH10 Mg N2 O12 P2P b c a11.49; 23.66; 8.62
90; 90; 90
2343.38Khan, A. A.; Baur, W. H.
Salt hydrates. VIII. The crystal structures of sodium ammonium orthochromate dihydrate and magnesium diammonium bis(hydrogen orthophosphate) tetrahydrate and a discussion of the ammonium ion
Acta Crystallographica, Section B, 1972, 28, 683-693
9007549 CIFC H6 Mg O6P 1 21/n 17.7053; 5.3673; 12.1212
90; 90.451; 90
501.277Stephan, G. W.; MacGillavry, C. H.
The crystal structure of nesquehonite, MgCO3*3H2O
Acta Crystallographica, Section B, 1972, 28, 1031-1033
9007550 CIFCa Cu4 H12 O17 S2P 1 21/c 120.87; 6.135; 22.191
90; 102.73; 90
2771.44Sabelli, C.; Zanazzi, P. F.
The crystal structure of devillite Note: z-coordinate of Cu7 altered to match reported bond lengths
Acta Crystallographica, Section B, 1972, 28, 1182-1189
9007551 CIFNi5.629 S4.86B m m b3.274; 16.157; 11.359
90; 90; 90
600.869Fleet, M. E.
The crystal structure of alpha-Ni7S6
Acta Crystallographica, Section B, 1972, 28, 1237-1241
9007552 CIFH10 Mg O9 SP -16.314; 10.505; 6.03
81.12; 109.82; 105.08
362.347Baur, W. H.; Rolin, J. L.
Salt hydrates. IX. The comparison of the crystal structure of magnesium sulfate pentahydrate with copper sulfate pentahydrate and magnesium chromate pentahydrate Locality: synthetic
Acta Crystallographica, Section B, 1972, 28, 1448-1455
9007553 CIFF Mn2 O4 PC 1 2/c 113.41; 6.5096; 10.094
90; 119.99; 90
763.169Rea, J. R.; Kostiner, E.
The crystal structure of manganese fluorophosphate, Mn2(PO4)F
Acta Crystallographica, Section B, 1972, 28, 2525-2529
9007554 CIFN Na O3R -3 c :H5.07; 5.07; 16.82
90; 90; 120
374.432Paul, G. L.; Pryor, A. W.
The study of sodium nitrate by neutron diffraction Sample: T = 20 C
Acta Crystallographica, Section B, 1972, 28, 2700-2702
9007555 CIFN Na O3R -3 c :H5.074; 5.074; 16.97
90; 90; 120
378.367Paul, G. L.; Pryor, A. W.
The study of sodium nitrate by neutron diffraction Sample: T = 100 C
Acta Crystallographica, Section B, 1972, 28, 2700-2702
9007556 CIFN Na O3R -3 c :H5.077; 5.077; 17.13
90; 90; 120
382.386Paul, G. L.; Pryor, A. W.
The study of sodium nitrate by neutron diffraction Sample: T = 180 C
Acta Crystallographica, Section B, 1972, 28, 2700-2702
9007557 CIFN Na O3R -3 c :H5.079; 5.079; 17.23
90; 90; 120
384.922Paul, G. L.; Pryor, A. W.
The study of sodium nitrate by neutron diffraction Sample: T = 230 C
Acta Crystallographica, Section B, 1972, 28, 2700-2702
9007558 CIFN Na O3R -3 c :H5.081; 5.081; 17.27
90; 90; 120
386.119Paul, G. L.; Pryor, A. W.
The study of sodium nitrate by neutron diffraction Sample: T = 250 C
Acta Crystallographica, Section B, 1972, 28, 2700-2702
9007559 CIFN Na O3R -3 c :H5.082; 5.082; 17.31
90; 90; 120
387.166Paul, G. L.; Pryor, A. W.
The study of sodium nitrate by neutron diffraction Sample: T = 268 C
Acta Crystallographica, Section B, 1972, 28, 2700-2702
9007560 CIFN Na O3R -3 m :H5.084; 5.084; 8.175
90; 90; 120
182.991Paul, G. L.; Pryor, A. W.
The study of sodium nitrate by neutron diffraction Sample: T = 290 C
Acta Crystallographica, Section B, 1972, 28, 2700-2702
9007561 CIFN Na O3R -3 c :H5.07; 5.07; 16.82
90; 90; 120
374.432Paul, G. L.; Pryor, A. W.
The study of sodium nitrate by neutron diffraction Sample: T = 20 C, refined incorporating curvilinear motion of O atom
Acta Crystallographica, Section B, 1972, 28, 2700-2702
9007562 CIFN Na O3R -3 c :H5.074; 5.074; 16.97
90; 90; 120
378.367Paul, G. L.; Pryor, A. W.
The study of sodium nitrate by neutron diffraction Sample: T = 100 C, refined incorporating curvilinear motion of O atom
Acta Crystallographica, Section B, 1972, 28, 2700-2702
9007563 CIFN Na O3R -3 c :H5.077; 5.077; 17.13
90; 90; 120
382.386Paul, G. L.; Pryor, A. W.
The study of sodium nitrate by neutron diffraction Sample: T = 180 C, refined incorporating curvilinear motion of O atom
Acta Crystallographica, Section B, 1972, 28, 2700-2702
9007564 CIFN Na O3R -3 c :H5.079; 5.079; 17.23
90; 90; 120
384.922Paul, G. L.; Pryor, A. W.
The study of sodium nitrate by neutron diffraction Sample: T = 230 C, refined incorporating curvilinear motion of O atom
Acta Crystallographica, Section B, 1972, 28, 2700-2702
9007565 CIFN Na O3R -3 c :H5.081; 5.081; 17.27
90; 90; 120
386.119Paul, G. L.; Pryor, A. W.
The study of sodium nitrate by neutron diffraction Sample: T = 250 C, refined incorporating curvilinear motion of O atom
Acta Crystallographica, Section B, 1972, 28, 2700-2702
9007566 CIFN Na O3R -3 c :H5.082; 5.082; 17.31
90; 90; 120
387.166Paul, G. L.; Pryor, A. W.
The study of sodium nitrate by neutron diffraction Sample: T = 268 C, refined incorporating curvilinear motion of O atom
Acta Crystallographica, Section B, 1972, 28, 2700-2702
9007567 CIFN Na O3R -3 m :H5.084; 5.084; 8.175
90; 90; 120
182.991Paul, G. L.; Pryor, A. W.
The study of sodium nitrate by neutron diffraction Sample: T = 290 C, refined incorporating curvilinear motion of O atom
Acta Crystallographica, Section B, 1972, 28, 2700-2702
9007568 CIFAl0.7 Ca12.098 F8.4 H13 Mg0.1 Na0.102 O35.6 Si10R -3 :H9.36; 9.36; 36.48
90; 90; 120
2767.82Merlino, S.
The crystal structure of zeophyllite
Acta Crystallographica, Section B, 1972, 28, 2726-2732
9007569 CIFK2 O4 SP n a m7.476; 10.071; 5.763
90; 90; 90
433.901McGinnety, J. A.
Redetermination of the structures of potassium sulphate and potassium chromate: the effect of electrostatic crystal forces upon observed bond length
Acta Crystallographica, Section B, 1972, 28, 2845-2852
9007570 CIFCr K2 O4P n a m7.663; 10.388; 5.922
90; 90; 90
471.41McGinnety, J. A.
Redetermination of the structures of potassium sulphate and potassium chromate: the effect of electrostatic crystal forces upon observed bond length
Acta Crystallographica, Section B, 1972, 28, 2845-2852
9007571 CIFAs H15 Mg O11C 1 2/c 16.6918; 25.744; 11.538
90; 95.15; 90
1979.67Ferraris, G.; Franchini-Angela M
Hydrogen bonding in the crystalline state. Crystal structure of MgHAsO4*7H2O roesslerite Note: B(1,3) of O2 was altered to reproduce axial lengths
Acta Crystallographica, Section B, 1973, 29, 286-292
9007572 CIFCu Fe S2I -4 2 d5.289; 5.289; 10.423
90; 90; 90
291.568Hall, S. R.; Stewart, J. M.
The crystal structure refinement of chalcopyrite, CuFeS2
Acta Crystallographica, Section B, 1973, 29, 579-585
9007573 CIFAs H16 Mg N O10P m n 217.054; 6.205; 11.368
90; 90; 90
497.578Ferraris, G.; Franchini-Angela M
Hydrogen bonding in the crystalline state. Refinement of the crystal structure of MgNH4AsO4*6(H2O), arsenstruvite
Acta Crystallographica, Section B, 1973, 29, 859-863
9007574 CIFNi0.5 Pd Pt2.5 S4P 42/m6.38; 6.38; 6.57
90; 90; 90
267.428Childs, J. D.; Hall, S. R.
The crystal structure of braggite, (Pt,Pd,Ni)S
Acta Crystallographica, Section B, 1973, 29, 1446-1451
9007575 CIFC H6 Cu2 O21 Pb5 S3P m n 2120.089; 7.146; 6.56
90; 90; 90
941.727Giacovazzo, C.; Menchetti, S.; Scordari, F.
The crystal structure of caledonite, Cu2Pb5(SO4)3CO3(OH)6
Acta Crystallographica, Section B, 1973, 29, 1986-1990
9007576 CIFBa6 Cl4.6 Fe0.15 H0.5 Mn2.082 O19 Si6 Ti0.768P 6/m m m16.398; 16.398; 7.2
90; 90; 120
1676.66Kampf, A. R.; Khan, A. A.; Baur, W. H.
Barium chloride silicate with an open framework: verplanckite
Acta Crystallographica, Section B, 1973, 29, 2019-2021
9007577 CIFAl H4 O6 PP 1 21/n 15.178; 9.514; 8.454
90; 90.35; 90
416.466Kniep, R.; Mootz, D.
Metavariscite - A redetermination of its crystal structure
Acta Crystallographica, Section B, 1973, 29, 2292-2294
9007578 CIFBi Cu3 S3P 21 21 217.723; 10.395; 6.716
90; 90; 90
539.164Kocman, V.; Nuffield, E. W.
The crystal structure of wittichenite, Cu3BiS3
Acta Crystallographica, Section B, 1973, 29, 2528-2535
9007579 CIFAs S3 SbP 1 21/a 111.8568; 9.0152; 10.1938
90; 116.365; 90
976.29Guillermo, T. R.; Wuensch, B. J.
The crystal structure of getchellite, AsSbS3
Acta Crystallographica, Section B, 1973, 29, 2536-2541
9007580 CIFH6 N O4 PI -4 2 d7.4997; 7.4997; 7.5494
90; 90; 90
424.62Khan, A. A.; Baur, W. H.
Refinement of the crystal structures of ammonium dihydrogen phosphate and ammonium dihydrogen arsenate Note: known as ADP
Acta Crystallographica, Section B, 1973, 29, 2721-2726
9007581 CIFAs H6 N O4I -4 2 d7.6998; 7.6998; 7.7158
90; 90; 90
457.446Khan, A. A.; Baur, W. H.
Refinement of the crystal structures of ammonium dihydrogen phosphate and ammonium dihydrogen arsenate Note: known as ADA
Acta Crystallographica, Section B, 1973, 29, 2721-2726
9007582 CIFH2 K O4 PP 21 21 217.434; 7.434; 6.945
90; 90; 90
383.811Baur, W. H.
Reconstruction of local atomic environments in the disordered hydrogen-bonded crystal structures of paraelectric ammonium dihydrogen phosphate and potassium dihydrogen phosphate Note: known as KDP Note: polymorph of archerite
Acta Crystallographica, Section B, 1973, 29, 2726-2731
9007583 CIFH6 N O4 PP 21 21 217.4997; 7.4997; 7.5493
90; 90; 90
424.614Baur, W. H.
Reconstruction of local atomic environments in the disordered hydrogen-bonded crystal structures of paraelectric ammonium dihydrogen phosphate and potassium dihydrogen phosphate Note: polymorph of biphosphammite
Acta Crystallographica, Section B, 1973, 29, 2726-2731
9007584 CIFH12 O16 S2 V2P 1 21/c 17.411; 7.439; 12.272
90; 108.9; 90
640.084Theobald, F.; Galy, J.
Structure cristalline de VOSO4((H2O)3 Locality: synthetic Note: polymorph of bobjonesite
Acta Crystallographica, Section B, 1973, 29, 2732-2736
9007585 CIFCu2 O7 V2F d d 220.68; 8.411; 6.448
90; 90; 90
1121.56Mercurio-Lavaud D; Frit, B.
Structure cristalline de la variete basse temperature du pyrovanadate de cuivre: Cu2V2O7 alpha
Acta Crystallographica, Section B, 1973, 29, 2737-2741
9007586 CIFAs2 Fe H5 O10 Pb ZnC 1 2/m 19.124; 6.329; 7.577
90; 115.28; 90
395.637Tillmanns, E.; Gebert, W.
The crystal structure of tsumcorite, a new mineral from the Tsumeb Mine, S.W. Africa Locality: Tsumeb mine, Namibia, Africa
Acta Crystallographica, Section B, 1973, 29, 2789-2794
9007587 CIFO3 Sb2P c c n4.911; 12.464; 5.412
90; 90; 90
331.272Svensson, C.
The crystal structure of orthorhombic antimony trioxide, Sb2O3
Acta Crystallographica, Section B, 1974, 30, 458-461
9007588 CIFCu3 H4 I6 O20P -17.256; 7.9503; 7.8559
105.096; 92.945; 96.952
432.702Ghose, S.; Wan, C.
Structural chemistry of copper and zinc minerals. II. Stereochemistry of copper(II) and iodine(V) in bellingerite, 3Cu(IO3)2.2H2O
Acta Crystallographica, Section B, 1974, 30, 965-974
9007589 CIFAl9 Ba3.5 Ca5.5 H2 K0.5 Na0.5 O55 S3 Si11P -6 2 m13.511; 13.511; 7.462
90; 90; 120
1179.67Merlino, S.
The crystal structure of wenkite
Acta Crystallographica, Section B, 1974, 30, 1262-1266
9007590 CIFSb2 Te3R -3 m :H4.264; 4.264; 30.458
90; 90; 120
479.586Anderson, T. L.; Krause, H. B.
Refinement of the Sb2Te3 and Sb2Te3Se structures and their relationship to nonstoichiometric Sb2Te(3-y)Se(y) compounds Sample: T = 29 C
Acta Crystallographica, Section B, 1974, 30, 1307-1310
9007591 CIFSb2 Se Te2R -3 m :H4.188; 4.188; 29.937
90; 90; 120
454.729Anderson, T. L.; Krause, H. B.
Refinement of the Sb2Te3 and Sb2Te3Se structures and their relationship to nonstoichiometric Sb2Te(3-y)Se(y) compounds Sample: T = 29 C
Acta Crystallographica, Section B, 1974, 30, 1307-1310
9007592 CIFAl3 H4 Na O12 P2P 1 21/n 111.233; 10.142; 7.097
90; 97.37; 90
801.847Gatehouse, B. M.; Miskin, B. K.
The crystal structure of brazilianite, NaAl3(PO4)2(OH)4
Acta Crystallographica, Section B, 1974, 30, 1311-1317
9007593 CIFS8P 1 2/c 18.442; 13.025; 9.356
90; 124.98; 90
842.915Watanabe, Y.
The crystal structure of monoclinic gamma-sulfur
Acta Crystallographica, Section B, 1974, 30, 1396-1401
9007594 CIFAs5 Ca6.25 H20 O30P 1 21/n 117.63; 6.734; 23.47
90; 90.6; 90
2786.22Catti, M.; Ferraris, G.
Crystal structure of Ca5(HAsO4)2(AsO4)2*9H2O (guerinite)
Acta Crystallographica, Section B, 1974, 30, 1789-1794
9007595 CIFO4 Sn WP n n a5.627; 11.6486; 4.9973
90; 90; 90
327.556Jeitschko, W.; Sleight, A. W.
Alpha stannous tungstate: Properties, crystal structure and relationship to ferroelectric SbTaO4 type compounds
Acta Crystallographica, Section B, 1974, 30, 2088-2094
9007596 CIFB3 H15 Mg O13P -18.3479; 10.6068; 6.4447
98.846; 108.981; 105.581
501.239Corazza, E.
The crystal structure of kurnakovite: a refinement
Acta Crystallographica, Section B, 1974, 30, 2194-2199
9007597 CIFF H28 Na7 O27 P2F d -3 c :227.755; 27.755; 27.755
90; 90; 90
21380.8Baur, W. H.; Tillmanns, E.
Salt hydrates. X. The crystal structure determinations of heptasodium fluoride bisphosphate 19-hydrate and heptasodium fluoride bisarsenate 19-hydrate and the computer simulation of the isomorphous vanadate salt Note: not all H were located Locality: synthetic
Acta Crystallographica, Section B, 1974, 30, 2218-2224
9007598 CIFAs2 F H28 Na7 O27F d -3 c :228.12; 28.12; 28.12
90; 90; 90
22235.5Baur, W. H.; Tillmanns, E.
Salt hydrates. X. The crystal structure determination of heptasodium fluoride bisphosphate 19-hydrate and heptasodium fluoride bisarsenate 19-hydrate and the computer simulation of the isomorphous vanadate salt
Acta Crystallographica, Section B, 1974, 30, 2218-2224
9007599 CIFMg2 O7 V2P -113.767; 5.414; 4.912
81.42; 106.82; 130.33
266.795Gopal, R.; Calvo, C.
Crystal structure of magnesium divanadate, Mg2V2O7 Note: There is likely a minor typo in coordinates of O6 because bond lengths cannot be reproduced
Acta Crystallographica, Section B, 1974, 30, 2491-2493
9007600 CIFCo2 O7 V2P 1 21/c 16.594; 8.38; 9.47
90; 100.17; 90
515.069Sauerbrei, E. E.; Faggiani, R.; Calvo, C.
Cobalt vanadate, Co2V2O7, and nickel vanadate, Ni2V2O7
Acta Crystallographica, Section B, 1974, 30, 2907-2909
9007601 CIFNi2 O7 V2P 1 21/c 16.515; 8.303; 9.35
90; 99.86; 90
498.309Sauerbrei, E. E.; Faggiani, R.; Calvo, C.
Cobalt vanadate, Co2V2O7, and nickel vanadate, Ni2V2O7 Note: x-coordinate of O7 altered to reproduce reported bond lengths
Acta Crystallographica, Section B, 1974, 30, 2907-2909
9007602 CIFCl Cu2 H3 O3R -3 :H13.654; 13.654; 14.041
90; 90; 120
2266.98Fleet, M. E.
The crystal structure of paratacamite, Cu2(OH)3Cl Sample: Ordered structure, considered to be the true structure
Acta Crystallographica, Section B, 1975, 31, 183-187
9007603 CIFCl Cu2 H3 O3R -3 :H6.827; 6.827; 14.041
90; 90; 120
566.746Fleet, M. E.
The crystal structure of paratacamite, Cu2(OH)3Cl Sample: Substructure, can be considered as the average structure
Acta Crystallographica, Section B, 1975, 31, 183-187
9007604 CIFCl Cu2 O3R -3 :H6.827; 6.827; 14.041
90; 90; 120
566.746Fleet, M. E.
The crystal structure of paratacamite, Cu2(OH)3Cl Sample: Substructure, with disordered oxygens
Acta Crystallographica, Section B, 1975, 31, 183-187
9007605 CIFAs Fe H4 O6P b c a10.325; 8.953; 10.038
90; 90; 90
927.91Kitahama, K.; Kiriyama, R.; Yoshihisa, B.
Refinement of the crystal structure of scorodite
Acta Crystallographica, Section B, 1975, 31, 322-324
9007606 CIFCu2 O7 V2F d d 220.645; 8.383; 6.442
90; 90; 90
1114.9Calvo, C.; Faggiani, R.
Alpha cupric divanadate
Acta Crystallographica, Section B, 1975, 31, 603-605
9007607 CIFB2 Ca3 O6R -3 c :H8.6377; 8.6377; 11.849
90; 90; 120
765.612Vegas, A.; Cano, F. H.; Garcia-Blanco S
The crystal structure of calcium orthoborate: a redetermination
Acta Crystallographica, Section B, 1975, 31, 1416-1419
9007608 CIFCu H4 Na2 O10 S2P 1 21/c 15.807; 12.656; 5.517
90; 108.32; 90
384.912Hawthorne, F. C.; Ferguson, R. B.
Refinement of the crystal structure of krohnkite
Acta Crystallographica, Section B, 1975, 31, 1753-1755
9007609 CIFO3 Sb2F d -3 m :111.1519; 11.1519; 11.1519
90; 90; 90
1386.91Svensson, C.
Refinement of the crystal structure of cubic antiomony trioxide, Sb2O3
Acta Crystallographica, Section B, 1975, 31, 2016-2018
9007610 CIFLi0.55 Mn4 Na0.45 O15 Si5P -17.621; 11.761; 6.731
92.767; 95.083; 106.867
573.345Narita, H.; Koto, K.; Morimoto, N.; Yoshii, M.
The crystal structure of nambulite (Li,Na)Mn4Si5O14(OH)
Acta Crystallographica, Section B, 1975, 31, 2422-2426
9007611 CIFCa3 H6 O10 Si2C 1 c 116.278; 5.6321; 13.236
90; 134.898; 90
859.577Malik, K. M. A.; Jeffery, J. W.
A re-investigation of the structure of afwillite
Acta Crystallographica, Section B, 1976, 32, 475-480
9007612 CIFB3 H15 Mg O13P 1 21/c 16.8221; 13.1145; 12.035
90; 104.552; 90
1042.21Corazza, E.
Inderite: Crystal structure refinement and relationship to kurnakovite
Acta Crystallographica, Section B, 1976, 32, 1329-1333
9007613 CIFAs H9 Mg O8P b c a7.472; 10.891; 16.585
90; 90; 90
1349.65Protas, J.; Gindt, R.
Structure cristalline de la brassite, MgHAsO4*4H2O, produit de deshydratation de la roesslerite Locality: synthetic
Acta Crystallographica, Section B, 1976, 32, 1460-1466
9007614 CIFAs3 Ca2 Mg1.7 Mn0.3 Na O12I a -3 d12.355; 12.355; 12.355
90; 90; 90
1885.94Hawthorne, F. C.
Refinement of the crystal structure of berzeliite Note: garnet structure
Acta Crystallographica, Section B, 1976, 32, 1581-1583
9007615 CIFBi5 Cu Pb S9P b n m33.531; 11.486; 4.003
90; 90; 90
1541.7Kohatsu, I.; Wuensch, B. J.
The crystal structure of gladite, PbCuBi5S9, a superstructure intermediate in the series Bi2S3-PbCuBiS3 (bismuthinite-aikinite)
Acta Crystallographica, Section B, 1976, 32, 2401-2409
9007616 CIFCa0.017 Fe0.614 Li0.301 Mg0.036 Mn0.333 Na0.014 O4 P0.965P m n b5.918; 10.037; 4.798
90; 90; 90
284.996Alberti, A.
Crystal structure of ferrisicklerite, Li<1(Fe3+,Mn2+)PO4
Acta Crystallographica, Section B, 1976, 32, 2761-2764
9007617 CIFO4 Pb WP 1 21/a 113.555; 4.976; 5.561
90; 107.63; 90
357.471Fujita, T.; Kawada, I.; Kato, K.
Raspite from Broken Hill
Acta Crystallographica, Section B, 1977, 33, 162-164
9007618 CIFAl H4 O6 PP b c a9.822; 8.561; 9.63
90; 90; 90
809.75Kniep, R.; Mootz, D.; Vegas, A.
Variscite
Acta Crystallographica, Section B, 1977, 33, 263-265
9007619 CIFCa4 H4 O16 P4P -16.91; 6.627; 6.998
96.34; 103.82; 88.33
309.275Catti, M.; Ferraris, G.; Filhol, A.
Hydrogen bonding in the crystalline state. CaHPO4 (monetite), P-1 or P1? A novel neutron diffraction study
Acta Crystallographica, Section B, 1977, 33, 1223-1229
9007620 CIFC4 H10 Mg5 O18P 1 21/c 110.105; 8.954; 8.378
90; 114.44; 90
690.118Akao, M.; Iwai, S.
The hydrogen bonding of hydromagnesite
Acta Crystallographica, Section B, 1977, 33, 1273-1275
9007621 CIFAs2 Ca Fe O7 SbI 41/a :216.144; 16.144; 10.706
90; 90; 90
2790.29Coda, A.; Dal Negro, A.; Sabelli, C.; Tazzoli, V.
The crystal structure of stenhuggarite
Acta Crystallographica, Section B, 1977, 33, 1807-1811
9007622 CIFAl2 Ba0.24 H10 K0.01 O21 Si6 Sr0.71P 1 21/m 16.793; 17.573; 7.759
90; 94.54; 90
923.312Schlenker, J. L.; Pluth, J. J.; Smith, J. V.
Refinement of the crystal structure of brewsterite, Ba0.5Sr1.5Al4Si12O32*10H2O
Acta Crystallographica, Section B, 1977, 33, 2907-2910
9007623 CIFC0.5 H4 Mg O4C 1 2/m 116.56; 3.153; 6.231
90; 99.1; 90
321.249Akao, M.; Iwai, S.
The hydrogen bonding of artinite Note: anisotropic displacement parameters obtained from ICSD
Acta Crystallographica, Section B, 1977, 33, 3951-3953
9007624 CIFO4 Si ThI 41/a m d :27.1328; 7.1328; 6.3188
90; 90; 90
321.481Taylor, M.; Ewing, R. C.
The crystal structure of the ThSiO4 polymorphs: huttonite and thorite
Acta Crystallographica, Section B, 1978, 34, 1074-1079
9007625 CIFO4 Si ThP 1 21/n 16.784; 6.974; 6.5
90; 104.92; 90
297.158Taylor, M.; Ewing, R. C.
The crystal structure of the ThSiO4 polymorphs: huttonite and thorite
Acta Crystallographica, Section B, 1978, 34, 1074-1079
9007626 CIFAl2 H18 O15 SP 1 21/c 17.44; 15.583; 11.7
90; 110.18; 90
1273.2Sabelli, C.; Ferroni, R. T.
The crystal structure of aluminite Note: anisotropic displacement factors from ICSD
Acta Crystallographica, Section B, 1978, 34, 2407-2412
9007627 CIFO4 Si Zn2R -3 :H13.948; 13.948; 9.315
90; 90; 120
1569.41Klaska, K.-H.; Eck, J. C.; Pohl, D.
New investigation of willemite Note: Anisotropic displacement parameters are from ICSD
Acta Crystallographica, Section B, 1978, 34, 3324-3325
9007628 CIFAs2 Cu3 H2 O10 PbC 1 2/c 110.147; 5.892; 14.081
90; 106.05; 90
809.034Ghose, S.; Wan, C.
Structural chemistry of copper and zinc minerals. VI. Bayldonite, (Cu,Zn)3Pb(AsO4)2(OH)2: A complex layer structure
Acta Crystallographica, Section B, 1979, 35, 819-823
9007629 CIFAs H Mn4 O13 Si3P 1 21/n 16.66; 19.92; 7.67
90; 95.7; 90
1012.53Gramaccioli, C. M.; Pilati, T.; Liborio, G.
Structure of a manganese(II) arsenatotrisilicate, Mn4[AsSi3O12(OH)]: The presence of a new tetrapolyphosphate-like anion Note: Displacement parameters taken from ICSD
Acta Crystallographica, Section B, 1979, 35, 2287-2291
9007630 CIFBa5 Cl O12 P3P 63/m10.284; 10.284; 7.651
90; 90; 120
700.766Hata, M.; Marumo, F.; Iwai, S.; Aoki, H.
Structure of barium chlorapatite
Acta Crystallographica, Section B, 1979, 35, 2382-2384
9007631 CIFAl Cl Cu H28 O22 S2P -16.282; 13.192; 6.26
91.85; 94.7; 82.46
512.443Ginderow, D.; Cesbron, F.
Structure cristalline de l'aubertite, AlCuCl(SO4)2*14H2O Note: anisotropic displacement parameters obtained from ICSD
Acta Crystallographica, Section B, 1979, 35, 2499-2502
9007632 CIFH7 Mg O7 PP b c a10.203; 10.678; 10.015
90; 90; 90
1091.11Abbona, F.; Boistelle, R.; Haser, R.
Hydrogen bonding in MgHPO4*3H2O (newberyite)
Acta Crystallographica, Section B, 1979, 35, 2514-2518
9007633 CIFAl2 H6 K Na O10.765 Si2I 1 2 110.226; 10.422; 9.884
90; 88.19; 90
1052.86Alberti, A.; Vezzalini, G.
The crystal structure of amicite, a zeolite
Acta Crystallographica, Section B, 1979, 35, 2866-2869
9007634 CIFAl2 O3R -3 c :H4.754; 4.754; 12.99
90; 90; 120
254.248Ishizawa, N.; Miyata, T.; Minato, I.; Marumo, F.; Iwai, S.
A structural investigation of alpha-Al2O3 at 2170 K T = 300 K
Acta Crystallographica, Section B, 1980, 36, 228-230
9007635 CIFAl2 O3R -3 c :H4.844; 4.844; 13.27
90; 90; 120
269.656Ishizawa, N.; Miyata, T.; Minato, I.; Marumo, F.; Iwai, S.
A structural investigation of alpha-Al2O3 at 2170 K T = 2170 K
Acta Crystallographica, Section B, 1980, 36, 228-230
9007636 CIFCa2 H K2 Na O20 Si7 TiP -110.377; 12.166; 7.059
90.91; 99.3; 92.76
878.187Bissert, G.
Verfeinerung der struktur von tinaksit, Ca2K2NaTiO[Si7O18(OH)] Note: z-coordinate of Si4 adjusted to match reported bond lengths
Acta Crystallographica, Section B, 1980, 36, 259-263
9007637 CIFAs O2P n m a8.597; 5.235; 7.269
90; 90; 90
327.143Jones, P. G.; Beesk, W.; Sheldrick, G. M.; Schwarzmann, E.
Arsenic dioxide
Acta Crystallographica, Section B, 1980, 36, 439-440
9007638 CIFK Na O4 SP 3 m 15.6066; 5.6066; 7.177
90; 90; 120
195.377Okada, K.; Ossaka, J.
Structures of potassium sodium sulphate and tripotassium sodium disulphate
Acta Crystallographica, Section B, 1980, 36, 919-921
9007639 CIFK3 Na O8 S2P -3 m 15.6801; 5.6801; 7.309
90; 90; 120
204.221Okada, K.; Ossaka, J.
Structures of potassium sodium sulphate and tripotassium sodium disulphate
Acta Crystallographica, Section B, 1980, 36, 919-921
9007640 CIFNi3 S2R 3 2 :R4.0718; 4.0718; 4.0718
89.459; 89.459; 89.459
67.5Parise, J. B.
Structure of hazelwoodite (Ni3S2)
Acta Crystallographica, Section B, 1980, 36, 1179-1180
9007641 CIFH42 Mg9 Mn1.882 O42 S2 Zn4P 1 21/a 111.147; 20.35; 8.202
90; 92.69; 90
1858.5Hill, R. J.
The structure of mooreite Note: Isotropic and anisotropic displacement factors taken from ICSD
Acta Crystallographica, Section B, 1980, 36, 1304-1311
9007642 CIFCa Cl6 H24 Mg2 O12R -3 :H10.136; 10.136; 17.318
90; 90; 120
1540.85Clark, J. R.; Evans, H. T.; Erd, R. C.
Tachyhydrite, dimagnesium calcium chloride 12-hydrate
Acta Crystallographica, Section B, 1980, 36, 2736-2739
9007643 CIFC O2P a -35.624; 5.624; 5.624
90; 90; 90
177.884Simon, A.; Peters, K.
Single-crystal refinement of the structure of carbon dioxide Sample: T = 150 K
Acta Crystallographica, Section B, 1980, 36, 2750-2751
9007644 CIFFe3 O4F d -3 m :28.3941; 8.3941; 8.3941
90; 90; 90
591.456Fleet, M. E.
The structure of magnetite
Acta Crystallographica, Section B, 1981, 37, 917-920
9007645 CIFC3 H10 Ca Na2 O16 UR -3 m :H17.902; 17.902; 23.734
90; 90; 120
6587.26Coda, A.; Della Giusta, A.; Tazzoli, V.
The structure of synthetic andersonite, Na2Ca[UO2(CO3)3].x(H2O) (x~5.6) Note: anisotropic displacement factors are from ICSD Note: B(2,2) for C2 changed to reproduce Biso and make positive definite
Acta Crystallographica, Section B, 1981, 37, 1496-1500
9007646 CIFBa0.1 Fe0.52 K0.66 Mg0.12 Na0.02 O8 Ti3.36I 4/m10.139; 10.139; 2.9664
90; 90; 90
304.944Post, J. E.; Von Dreele, R. B.; Buseck, P. R.
Symmetry and cation displacements in hollandites: structure refinements of hollandite, cryptomelane and priderite Note: Anisotropic displacement factors from ICSD
Acta Crystallographica, Section B, 1982, 38, 1056-1065
9007647 CIFAl0.08 Fe0.16 K0.65 Mn3.76 Na0.11 O8 Sr0.08I 1 2/m 19.956; 2.8705; 9.706
90; 90.95; 90
277.347Post, J. E.; Von Dreele, R. B.; Buseck, P. R.
Symmetry and cation displacements in hollandites: structure refinements of hollandite, cryptomelane and priderite Note: -1M polytype Note: Anisotropic displacement factors from ICSD
Acta Crystallographica, Section B, 1982, 38, 1056-1065
9007648 CIFAl0.12 Ba0.34 Fe0.64 Mn3.24 O8 Pb0.08I 1 2/m 110.026; 2.8782; 9.729
90; 91.03; 90
280.703Post, J. E.; Von Dreele, R. B.; Buseck, P. R.
Symmetry and cation displacements in hollandites: structure refinements of hollandite, cryptomelane and priderite Note: Anisotropic displacement factors from ICSD
Acta Crystallographica, Section B, 1982, 38, 1056-1065
9007649 CIFNa0.5 O13 Si3 Y4.5P 63/m9.334; 9.334; 6.759
90; 90; 120
509.975Gunawardane, R. P.; Howie, R. A.; Glasser, F. P.
Structure of the oxyapatite NaY9(SiO4)6O2 Note: apatite structure
Acta Crystallographica, Section B, 1982, 38, 1564-1566
9007650 CIFFe SP -6 2 c5.963; 5.963; 11.754
90; 90; 120
361.948King, Jr, H. E.; Prewitt, C. T.
High-pressure and high-temperature polymorphism of iron sulfides (FeS) Sample: T = 294 K, P = 0.0001 GPa
Acta Crystallographica, Section B, 1982, 38, 1877-1887
9007651 CIFFe SP -6 2 c5.999; 5.999; 11.71
90; 90; 120
364.96King, Jr, H. E.; Prewitt, C. T.
High-pressure and high-temperature polymorphism of iron sulfides (FeS) Sample: T = 393 K, P = 0.0001 GPa
Acta Crystallographica, Section B, 1982, 38, 1877-1887
9007652 CIFFe SP -6 2 c5.861; 5.861; 11.577
90; 90; 120
344.406King, Jr, H. E.; Prewitt, C. T.
High-pressure and high-temperature polymorphism of iron sulfides (FeS) Sample: T = 294 K, P = 3.33 GPa
Acta Crystallographica, Section B, 1982, 38, 1877-1887
9007653 CIFFe SP n m a5.825; 3.4675; 6.0059
90; 90; 90
121.308King, Jr, H. E.; Prewitt, C. T.
High-pressure and high-temperature polymorphism of iron sulfides (FeS) Sample: T = 463 K, P = 0.0001 GPa, MnP-type structure
Acta Crystallographica, Section B, 1982, 38, 1877-1887
9007654 CIFFe SP n m a5.716; 3.347; 5.797
90; 90; 90
110.905King, Jr, H. E.; Prewitt, C. T.
High-pressure and high-temperature polymorphism of iron sulfides (FeS) Sample: T = 294 K, P = 4.15 GPa, MnP-type structure Note: a cell edge altered from value reported
Acta Crystallographica, Section B, 1982, 38, 1877-1887
9007655 CIFFe SP n m a5.65; 3.3155; 5.7426
90; 90; 90
107.574King, Jr, H. E.; Prewitt, C. T.
High-pressure and high-temperature polymorphism of iron sulfides (FeS) Sample: T = 294 K, P = 6.35 GPa, MnP-type structure
Acta Crystallographica, Section B, 1982, 38, 1877-1887
9007656 CIFC2 H5 Na3 O8C 1 2/c 120.36; 3.48; 10.29
90; 106.48; 90
699.124Choi, C. S.; Mighell, A. D.
Neutron diffraction study of sodium sesquicarbonate dihydrate Note: H3 disordered model, this is the prefered model
Acta Crystallographica, Section B, 1982, 38, 2874-2876
9007657 CIFC2 H5 Na3 O8C 1 2/c 120.36; 3.48; 10.29
90; 106.48; 90
699.124Choi, C. S.; Mighell, A. D.
Neutron diffraction study of sodium sesquicarbonate dihydrate Note: H3 ordered model, this is least favoured
Acta Crystallographica, Section B, 1982, 38, 2874-2876
9007658 CIFB5 Ca H10 Na O14P 1 21/c 16.588; 12.56; 13.428
90; 99.97; 90
1094.32Menchetti, S.; Sabelli, C.; Trosti-Ferroni R
Probertite, CaNa[B5O7(OH)4]*3H2O: a refinement
Acta Crystallographica, Section B, 1982, 38, 3072-3075
9007659 CIFNi53 S54P 31 2 110.29; 10.29; 15.993
90; 90; 120
1466.53Collin, G.; Chavant, C.; Comes, R.
Structure and planar faults in the defective NiAs-type compound Ni17S18
Acta Crystallographica, Section B, 1983, 39, 289-296
9007660 CIFMo S2P 63/m m c3.161; 3.161; 12.295
90; 90; 120
106.392Schonfeld, B.; Huang, J. J.; Moss, S. C.
Anisotropic mean-square displacements (MSD) in single crystals of 2H- and 3R-MoS2 Note: 2H polytype, this is the most common in nature
Acta Crystallographica, Section B, 1983, 39, 404-407
9007661 CIFMo S2R 3 m :H3.163; 3.163; 18.37
90; 90; 120
159.162Schonfeld, B.; Huang, J. J.; Moss, S. C.
Anisotropic mean-square displacements (MSD) in single crystals of 2H- and 3R-MoS2 Note: 3R polytype
Acta Crystallographica, Section B, 1983, 39, 404-407
9007662 CIFAs CoP n a m5.2857; 5.8675; 3.4883
90; 90; 90
108.186Lyman, P. S.; Prewitt, C. T.
Room- and high-pressure crystal chemistry of CoAs and FeAs Note: anisoB's taken from ICSD Sample: Pnam refinement, P = .0001 GPa
Acta Crystallographica, Section B, 1984, 40, 14-20
9007663 CIFAs CoP n a 215.2857; 5.8675; 3.4883
90; 90; 90
108.186Lyman, P. S.; Prewitt, C. T.
Room- and high-pressure crystal chemistry of CoAs and FeAs Note: anisoB's taken from ICSD Sample: Pna2_1 refinement, P = .0001 GPa
Acta Crystallographica, Section B, 1984, 40, 14-20
9007664 CIFAs CoP n a m5.2675; 5.815; 3.4623
90; 90; 90
106.052Lyman, P. S.; Prewitt, C. T.
Room- and high-pressure crystal chemistry of CoAs and FeAs Note: anisoB's taken from ICSD Sample: P = 2.80 GPa
Acta Crystallographica, Section B, 1984, 40, 14-20
9007665 CIFAs CoP n a m5.2631; 5.801; 3.4569
90; 90; 90
105.543Lyman, P. S.; Prewitt, C. T.
Room- and high-pressure crystal chemistry of CoAs and FeAs Note: anisoB's taken from ICSD Sample: P = 3.70 GPa
Acta Crystallographica, Section B, 1984, 40, 14-20
9007666 CIFAs CoP n a m5.2575; 5.7782; 3.4453
90; 90; 90
104.664Lyman, P. S.; Prewitt, C. T.
Room- and high-pressure crystal chemistry of CoAs and FeAs Note: anisoB's taken from ICSD Sample: P = 4.90 GPa
Acta Crystallographica, Section B, 1984, 40, 14-20
9007667 CIFAs FeP n a 215.4401; 6.0259; 3.3712
90; 90; 90
110.513Lyman, P. S.; Prewitt, C. T.
Room- and high-pressure crystal chemistry of CoAs and FeAs Note: anisoB's taken from ICSD Sample: Pna2_1 refinement, P = .0001 GPa
Acta Crystallographica, Section B, 1984, 40, 14-20
9007668 CIFAs FeP n a m5.4401; 6.0259; 3.3712
90; 90; 90
110.513Lyman, P. S.; Prewitt, C. T.
Room- and high-pressure crystal chemistry of CoAs and FeAs Note: anisoB's taken from ICSD Sample: Pnam refinement, P = .0001 GPa
Acta Crystallographica, Section B, 1984, 40, 14-20
9007669 CIFAs FeP n a m5.424; 5.9948; 3.3386
90; 90; 90
108.557Lyman, P. S.; Prewitt, C. T.
Room- and high-pressure crystal chemistry of CoAs and FeAs Note: anisoB's taken from ICSD Sample: P = 2.25 GPa
Acta Crystallographica, Section B, 1984, 40, 14-20
9007670 CIFAs FeP n a m5.411; 5.9671; 3.3122
90; 90; 90
106.944Lyman, P. S.; Prewitt, C. T.
Room- and high-pressure crystal chemistry of CoAs and FeAs Note: anisoB's taken from ICSD Sample: P = 4.36 GPa
Acta Crystallographica, Section B, 1984, 40, 14-20
9007671 CIFAs FeP n a m5.403; 5.9488; 3.2902
90; 90; 90
105.752Lyman, P. S.; Prewitt, C. T.
Room- and high-pressure crystal chemistry of CoAs and FeAs Note: anisoB's taken from ICSD Sample: P = 6.10 GPa
Acta Crystallographica, Section B, 1984, 40, 14-20
9007672 CIFAs FeP n a m5.39; 5.928; 3.2662
90; 90; 90
104.361Lyman, P. S.; Prewitt, C. T.
Room- and high-pressure crystal chemistry of CoAs and FeAs Note: anisoB's taken from ICSD Sample: P = 8.3 GPa
Acta Crystallographica, Section B, 1984, 40, 14-20
9007673 CIFMn O3 TiR -3 :H5.139; 5.139; 14.283
90; 90; 120
326.669Kidoh, K.; Tanaka, K.; Marumo, F.; Takei, H.
Electron density distribution in ilmenite-type crystals. II. Manganese (II) titanium (IV) trioxide Sample: ilmenite structure
Acta Crystallographica, Section B, 1984, 40, 329-332
9007674 CIFH16 Mg N O10 PP m n 216.955; 6.142; 11.218
90; 90; 90
479.206Ferraris, G.; Fuess, H.; Joswig, W.
Neutron diffraction study of MgNH4PO4*6H2O (struvite) and survey of water molecules donating short hydrogen bonds
Acta Crystallographica, Section B, 1986, 42, 253-258
9007675 CIFB H3 O3P -17.0187; 7.035; 6.3472
92.49; 101.46; 119.76
262.901Gajhede, M.; Larsen, S.; Rettrup, S.
Electron density of orthoboric acid determined by X-ray diffraction at 105 K and ab initio calculations Note: multipole refinement
Acta Crystallographica, Section B, 1986, 42, 545-552
9007676 CIFAl1.5 H4 Na1.875 O6.125 S1.125 Si1.5I -4 3 m9.0338; 9.0338; 9.0338
90; 90; 90
737.244Tarling, S. E.; Barnes, P.; Klinowski, J.
The structure and Si,Al distribution of the ultramarines Note: disordered synthetic counterpart to lazurite Note: occupancies changed to match formula
Acta Crystallographica, Section B, 1988, 44, 128-135
9007677 CIFAs3 Ni8.499 O16R -3 m :R9.8105; 9.8105; 9.8105
35.312; 35.312; 35.312
281.837Fleet, M. E.; Barbier, J.
Structure of aerugite (Ni8.5As3O16) and interrelated arsenate and germanate structural series
Acta Crystallographica, Section B, 1989, 45, 201-205
9007678 CIFGe3 Mg5.467 Ni4.533 O16R -3 m :R10.125; 10.125; 10.125
33.79; 33.79; 33.79
286.075Fleet, M. E.; Barbier, J.
Structure of aerugite (Ni8.5As3O16) and interrelated arsenate and germanate structural series
Acta Crystallographica, Section B, 1989, 45, 201-205
9007679 CIFK O5 P TiP n a 2112.819; 6.399; 10.584
90; 90; 90
868.193Thomas, P. A.; Glazer, A. M.; Watts, B. E.
Crystal structure and nonlinear optical properties of KSnOPO4 and their comparison with KTiOPO4 Note: KTP structure
Acta Crystallographica, Section B, 1990, 46, 333-343
9007680 CIFK O5 P SnP n a 2113.145; 6.526; 10.738
90; 90; 90
921.151Thomas, P. A.; Glazer, A. M.; Watts, B. E.
Crystal structure and nonlinear optical properties of KSnOPO4 and their comparison with KTiOPO4 Note: KTP structure
Acta Crystallographica, Section B, 1990, 46, 333-343
9007681 CIFC4 H3 Na5 O12P -13.4762; 10.0393; 15.5969
107.77; 95.589; 95.028
511.906Fernandes, N. G.; Tellgren, R.; Olovsson, I.
Structure and electron density of pentasodium trihydrogentetracarbonate Note: anisotropic displacement factors from ICSD
Acta Crystallographica, Section B, 1990, 46, 466-474
9007682 CIFCo S2P a -35.5385; 5.5385; 5.5385
90; 90; 90
169.893Nowack, E.; Schwarzenbach, D.; Hahn, T.
Charge densities in CoS2 and NiS2 (pyrite structure) Note: multipole model
Acta Crystallographica, Section B, 1991, 47, 650-659
9007683 CIFNi S2P a -35.6765; 5.6765; 5.6765
90; 90; 90
182.912Nowack, E.; Schwarzenbach, D.; Hahn, T.
Charge densities in CoS2 and NiS2 (pyrite structure) Note: multipole model, T = 135 K
Acta Crystallographica, Section B, 1991, 47, 650-659
9007684 CIFAs2 Ni3 O8P 1 21/c 15.764; 9.559; 10.194
90; 92.95; 90
560.925Barbier, J.; Frampton, C.
Structures of orthorhombic and monoclinic Ni3(AsO4)2 Note: AnisoU's taken from ICSD
Acta Crystallographica, Section B, 1991, 47, 457-462
9007685 CIFAs2 Ni3 O8C m c e5.943; 11.263; 8.164
90; 90; 90
546.466Barbier, J.; Frampton, C.
Structures of orthorhombic and monoclinic Ni3(AsO4)2 Note: AnisoU's taken from ICSD Note: polymorph of xanthiosite
Acta Crystallographica, Section B, 1991, 47, 457-462
9007689 CIFC Ca O3R -3 c :H4.988; 4.988; 17.068
90; 90; 120
367.761Maslen, E. N.; Streltsov, V. A.; Streltsova, N. R.; Ishizawa, N.
Electron density and optical anisotropy in rhombohedral carbonates. III. Synchrotron X-ray studies of CaCO3, MgCO3 and MnCO3
Acta Crystallographica, Section B, 1995, 51, 929-939
9007690 CIFC Mn O3R -3 c :H4.772; 4.772; 15.637
90; 90; 120
308.379Maslen, E. N.; Streltsov, V. A.; Streltsova, N. R.; Ishizawa, N.
Electron density and optical anisotropy in rhombohedral carbonates. III. Synchrotron X-ray studies of CaCO3, MgCO3 and MnCO3 Sample: Synchrotron data
Acta Crystallographica, Section B, 1995, 51, 929-939
9007692 CIFC Mg O3R -3 c :H4.632; 4.632; 15.002
90; 90; 120
278.751Maslen, E. N.; Streltsov, V. A.; Streltsova, N. R.; Ishizawa, N.
Electron density and optical anisotropy in rhombohedral carbonates. III. Synchrotron X-ray studies of CaCO3, MgCO3 and MnCO3
Acta Crystallographica, Section B, 1995, 51, 929-939
9007694 CIFCo0.06 Cu0.68 Fe0.11 Ni0.15 S2P 1 21 15.709; 5.707; 5.708
90; 90.01; 90
185.974Marcos, C.; Paniagua, A.; Moreiras, D. B.; Garcia-Granda S; Diaz, M. R.
Villamaninite, a case of noncubic pyrite-type structure Sample: 1 Note: anisoU's from ICSD
Acta Crystallographica, Section B, 1996, 52, 899-904
9007695 CIFCo0.13 Cu0.53 Fe0.07 Ni0.27 S2P 1 21 15.704; 5.703; 5.704
90; 89.99; 90
185.551Marcos, C.; Paniagua, A.; Moreiras, D. B.; Garcia-Granda S; Diaz, M. R.
Villamaninite, a case of noncubic pyrite-type structure Sample: 2 Note: anisoU's from ICSD
Acta Crystallographica, Section B, 1996, 52, 899-904
9007697 CIFCu6 O8 PbF m -3 m9.314; 9.314; 9.314
90; 90; 90
807.995Winkler, B.; Chall, M.; Pickard, C. J.; Milman, V.; White, J.
Structure of Cu6PbO8 Note: these are model structure derived from quantum calculations This model appears to be the stable phase at ambient conditions
Acta Crystallographica, Section B, 2000, 56, 22-26
9007698 CIFCu6 O8 PbF m -3 m8.623; 8.623; 8.623
90; 90; 90
641.173Winkler, B.; Chall, M.; Pickard, C. J.; Milman, V.; White, J.
Structure of Cu6PbO8 Note: these are model structure derived from quantum calculations This model appears to be the stable phase at high pressure
Acta Crystallographica, Section B, 2000, 56, 22-26
9007701 CIFAl2 Mn3 O12 Si3I a -3 d11.63; 11.63; 11.63
90; 90; 90
1573.04Gramaccioli, C. M.; Pilati, T.; Demartin, F.
Atomic displacement parameters for spessartine Mn3Al2Si3O12 and their lattice-dynamical interpretation
Acta Crystallographica, Section B, 2002, 58, 965-969
9011080 CIFCl2 Hg3 S2I 21 38.949; 8.949; 8.949
90; 90; 90
716.677Frueh, A. J.; Gray, N.
Confirmation and refinement of the structure of Hg3S2Cl2
Acta Crystallographica, Section B, 1968, 24, 156-157
9011083 CIFAl Cl3 H12 O6R -3 c :H11.827; 11.827; 11.895
90; 90; 120
1440.94Buchanan, D. R.; Harris, P. M.
A neutron and X-ray diffraction investigation of aluminium chloride hexahydrate Locality: synthetic Sample: single crystal X-ray diffraction data
Acta Crystallographica, Section B, 1968, 24, 954-960
9011085 CIFNa2 O5 Si2P 1 21/a 112.329; 4.848; 8.133
90; 104.24; 90
471.181Pant, A. K.
A reconsideration of the crystal structure of beta-Na2Si2O5
Acta Crystallographica, Section B, 1968, 24, 1077-1083
9011086 CIFCl Hg1.5 SA 2 m m4.664; 16.82; 9.081
90; 90; 90
712.391Durovic, S.
The crystal structure of gamma-Hg3S2Cl2 Sample: one-layer structure used for interatomic functions
Acta Crystallographica, Section B, 1968, 24, 1661-1670
9011088 CIFCl Hg1.5 SP b m m9.328; 8.41; 4.5405
90; 90; 90
356.195Durovic, S.
The crystal structure of gamma-Hg3S2Cl2 Sample: superposition structure
Acta Crystallographica, Section B, 1968, 24, 1661-1670
9011089 CIFGaC 1 2/c 12.766; 8.053; 3.332
90; 92.02; 90
74.173Bosio, L.; Defrain, A.; Curien, H.; Rimsky, A.
Structure cristalline du gallium-beta Sample: at T = 248.15 K Note: structure known as beta phase
Acta Crystallographica, Section B, 1969, 25, 995-995
9011090 CIFFe7 O10 SiP 1 21/m 121.4; 3.06; 5.88
90; 98; 90
381.299Smuts, J.; Steyn, J. G. D.; Boeyens, J. C. A.
The crystal structure of an iron silicate, iscorite
Acta Crystallographica, Section B, 1969, 25, 1251-1255
9011091 CIFCa5 H O13 P3P 63/m9.424; 9.424; 6.879
90; 90; 120
529.086Sudarsanan, K.; Young, R. A.
Significant precision in crystal structural details: Holly Springs hydroxyapatite Locality: Holly Springs, Cherokee County, Georgia, USA Sample: X-23-4
Acta Crystallographica, Section B, 1969, 25, 1534-1543
9011092 CIFCa5 H O13 P3P 63/m9.424; 9.424; 6.879
90; 90; 120
529.086Sudarsanan, K.; Young, R. A.
Significant precision in crystal structural details: Holly Springs hydroxyapatite Locality: Holly Springs, Cherokee County, Georgia, USA Sample: X-23-6
Acta Crystallographica, Section B, 1969, 25, 1534-1543
9011093 CIFCa5 H O13 P3P 63/m9.424; 9.424; 6.879
90; 90; 120
529.086Sudarsanan, K.; Young, R. A.
Significant precision in crystal structural details: Holly Springs hydroxyapatite Locality: Holly Springs, Cherokee County, Georgia, USA Sample: X-23-10
Acta Crystallographica, Section B, 1969, 25, 1534-1543
9011094 CIFCa5 H O13 P3P 63/m9.424; 9.424; 6.879
90; 90; 120
529.086Sudarsanan, K.; Young, R. A.
Significant precision in crystal structural details: Holly Springs hydroxyapatite Locality: Holly Springs, Cherokee County, Georgia, USA Sample: Neutron
Acta Crystallographica, Section B, 1969, 25, 1534-1543
9011099 CIFCl Fe2 O12 Te4P -18.89; 5.08; 6.63
103.17; 107.08; 77.87
275.366Dusausoy, Y.; Protas, J.
Determination et etude de la structure cristalline de la rodalquilarite, chlorotellurite acide de fer
Acta Crystallographica, Section B, 1969, 25, 1551-1558
9011100 CIFC H30 Ca3 Mn O25 SP 6311.06; 11.06; 10.5
90; 90; 120
1112.32Granger, M. M.; Protas, J.
Determination et etude de la structure cristalline de la jouravskite Ca3MnIV(SO4)(CO3)(OH)*12(H2O)
Acta Crystallographica, Section B, 1969, 25, 1943-1951
9011101 CIFB5 H4 N O10P 1 21/c 19.47; 7.63; 11.65
90; 97.08; 90
835.365Merlino, S.; Sartori, F.
The crystal structure of lardellite, NH4B5O7(OH)2*H2O
Acta Crystallographica, Section B, 1969, 25, 2264-2270
9011102 CIFC H20 Na2 O13C 1 c 112.83; 9.026; 13.44
90; 123; 90
1305.31Taga, T.
Crystal structure of Na2CO3*10H2O
Acta Crystallographica, Section B, 1969, 25, 2656-2657
9011103 CIFAl2 Ca6 H66 O49.68 S3P 3 1 c11.26; 11.26; 21.48
90; 90; 120
2358.53Moore, A. E.; Taylor, H. F. W.
Crystal structure of ettringite
Acta Crystallographica, Section B, 1970, 26, 386-393
9011104 CIFO7 Si2 Yb2C 1 2/m 16.802; 8.875; 4.703
90; 102.12; 90
277.581Smolin, Y. I.; Shepelev, Y. F.
The crystal structures of the rare earth pyrosilicates
Acta Crystallographica, Section B, 1970, 26, 484-492
9011105 CIFEr2 O7 Si2P 1 1 21/b4.683; 5.556; 10.79
90; 90; 96
279.204Smolin, Y. I.; Shepelev, Y. F.
The crystal structures of the rare earth pyrosilicates
Acta Crystallographica, Section B, 1970, 26, 484-492
9011106 CIFGd2 O7 Si2P n a 2113.87; 5.073; 8.33
90; 90; 90
586.12Smolin, Y. I.; Shepelev, Y. F.
The crystal structures of the rare earth pyrosilicates
Acta Crystallographica, Section B, 1970, 26, 484-492
9011107 CIFNd2 O7 Si2P 21 21 215.394; 12.95; 8.72
90; 90; 90
609.112Smolin, Y. I.; Shepelev, Y. F.
The crystal structures of the rare earth pyrosilicates
Acta Crystallographica, Section B, 1970, 26, 484-492
9011108 CIFMnI -4 3 m8.911; 8.911; 8.911
90; 90; 90
707.586Oberteuffer, J. A.; Ibers, J. A.
A refinement of the atomic and thermal parameters of alpha-manganese from a single crystal
Acta Crystallographica, Section B, 1970, 26, 1499-1504
9011109 CIFB35R -3 m :R10.17; 10.17; 10.17
65.12; 65.12; 65.12
826.857Geist, D.; Kloss, R.; Follner, H.
Verfeinerung des beta-rhomboedrischen bors
Acta Crystallographica, Section B, 1970, 26, 1800-1802
9011110 CIFO9 Te3 UP a -311.37; 11.37; 11.37
90; 90; 90
1469.88Galy, J.; Meunier, G.
A propos de la cliffordite UTe3O8. Le Systeme UO3-TeO2 a 700 C. Structure cristalline de UTe3O9 Sample: T = 700 C
Acta Crystallographica, Section B, 1971, 27, 608-616
9011111 CIFB2 Ca H12 O10C 1 2/c 116.07999; 6.69; 7.95
90; 104.9; 90
826.466Sedlacek, P.; Dornberger-Schiff K
An OD-Disordered modification of the calcium monoborate dihydrate Ca[B(OH)4]2*2H2O Sample: MDO (1)
Acta Crystallographica, Section B, 1971, 27, 1532-1541
9011112 CIFB2 Ca H12 O10P 1 2/c 18.04; 6.69; 7.95
90; 104.9; 90
413.233Sedlacek, P.; Dornberger-Schiff K
An OD-Disordered modification of the calcium monoborate dihydrate Ca[B(OH)4]2*2H2O Sample: MDO (2)
Acta Crystallographica, Section B, 1971, 27, 1532-1541
9011113 CIFAl Ca2 Fe O5I b m 25.584; 14.6; 5.374
90; 90; 90
438.123Colville, A. A.; Geller, S.
The crystal structure of brownmillerite, Ca2FeAlO5 Note: no bond lengths could be reproduced
Acta Crystallographica, Section B, 1971, 27, 2311-2315
9011114 CIFC5 H7 N5 O2P 1 21/n 116.51; 11.277; 3.645
90; 96.8; 90
673.864Thewalt, U.; Bugg, C. E.; Marsh, R. E.
The crystal structure of guanine monohydrate
Acta Crystallographica, Section B, 1971, 27, 2358-2362
9011115 CIFK2 Mg5 O30 Si12P 6/m c c10.222; 10.222; 14.152
90; 90; 120
1280.62Khan, A. A.; Baur, W. H.; Forbes, W. C.
Synthetic magnesian merrihueite, dipotassium pentamagnesium dodecasilicate: a tetrahedral magnesiosilicate framework crystal structure
Acta Crystallographica, Section B, 1972, 28, 267-272
9011116 CIFSe8P 1 21/n 19.054; 9.083; 11.601
90; 90.81; 90
953.942Cherin, P.; Unger, P.
Refinement of the crystal structure of alpha-monoclinic Se Sample: at T = 26 C Note: structure known as alpha phase
Acta Crystallographica, Section B, 1972, 28, 313-317
9011117 CIFAg5 Hg7.55I 2 310.0506; 10.0506; 10.0506
90; 90; 90
1015.26Fairhurst, C. W.; Cohen, J. B.
The crystal structure of two compounds found in dental amalgam: Ag2Hg3 and Ag3Sn
Acta Crystallographica, Section B, 1972, 28, 371-378
9011118 CIFAg3 SnP m m n :25.968; 4.7802; 5.1843
90; 90; 90
147.899Fairhurst, C. W.; Cohen, J. B.
The crystal structure of two compounds found in dental amalgam: Ag2Hg3 and Ag3Sn
Acta Crystallographica, Section B, 1972, 28, 371-378
9011119 CIFC8 H5 N O2P 1 21/n 122.83; 7.651; 3.81
90; 91.36; 90
665.314Matzat, E.
Die kristallstruktur des phtalimids (kladnoit)
Acta Crystallographica, Section B, 1972, 28, 415-418
9011120 CIFGaC m c m10.593; 13.523; 5.203
90; 90; 90
745.325Bosio, L.; Curien, H.; Dupont, M.; Rimsky, A.
Structure cristalline de Ga-gamma Sample: at T = 220 K Note: structure known as gamma phase
Acta Crystallographica, Section B, 1972, 28, 1974-1975
9011121 CIFH9 N2 O4 PP 1 21/c 111.043; 6.7; 8.031
90; 113.42; 90
545.246Khan, A. A.; Roux, J. P.; James, W. J.
The crystal structure of diammonium hydrogen phosphate, (NH4)2HPO4
Acta Crystallographica, Section B, 1972, 28, 2065-2069
9011122 CIFH4 Mo O5P 1 21/n 110.476; 13.822; 10.606
90; 91.62; 90
1535.13Krebs, B.
Die kristallstruktur von MoO3*2H2O
Acta Crystallographica, Section B, 1972, 28, 2222-2231
9011123 CIFC2 H10 N2 O5P 21 21 28.035; 10.309; 3.795
90; 90; 90
314.351Taylor, J. C.; Sabine, T. M.
Isotope and bonding effects in ammonium oxalate monohydrate, determined by the combined use of neutron and X-ray diffraction analyses Locality: synthetic Sample: HOX(XR)
Acta Crystallographica, Section B, 1972, 28, 3340-3351
9011124 CIFC2 H10 N2 O5P 21 21 28.025; 10.3; 3.799
90; 90; 90
314.016Taylor, J. C.; Sabine, T. M.
Isotope and bonding effects in ammonium oxalate monohydrate, determined by the combined use of neutron and X-ray diffraction analyses Locality: synthetic Sample: NOX(XR)
Acta Crystallographica, Section B, 1972, 28, 3340-3351
9011125 CIFC2 H10 N2 O5P 21 21 28.027; 10.298; 3.816
90; 90; 90
315.438Taylor, J. C.; Sabine, T. M.
Isotope and bonding effects in ammonium oxalate monohydrate, determined by the combined use of neutron and X-ray diffraction analyses Locality: synthetic Sample: DOX(XR)
Acta Crystallographica, Section B, 1972, 28, 3340-3351
9011126 CIFC2 H10 N2 O5P 21 21 28.035; 10.309; 3.795
90; 90; 90
314.351Taylor, J. C.; Sabine, T. M.
Isotope and bonding effects in ammonium oxalate monohydrate, determined by the combined use of neutron and X-ray diffraction analyses Locality: synthetic Sample: HOX(N)
Acta Crystallographica, Section B, 1972, 28, 3340-3351
9011127 CIFC2 H2 N2 O5P 21 21 28.025; 10.3; 3.799
90; 90; 90
314.016Taylor, J. C.; Sabine, T. M.
Isotope and bonding effects in ammonium oxalate monohydrate, determined by the combined use of neutron and X-ray diffraction analyses Locality: synthetic Sample: NOX(N)
Acta Crystallographica, Section B, 1972, 28, 3340-3351
9011128 CIFC2 H10 N2 O5P 21 21 28.027; 10.298; 3.816
90; 90; 90
315.438Taylor, J. C.; Sabine, T. M.
Isotope and bonding effects in ammonium oxalate monohydrate, determined by the combined use of neutron and X-ray diffraction analyses Locality: synthetic Sample: DOX(N)
Acta Crystallographica, Section B, 1972, 28, 3340-3351
9011129 CIFCl10 Cu4 K4 OC 1 2/c 114.7; 14.88; 8.95
90; 104.74; 90
1893.26de Boer, J. J.; Bright, D.; Helle, J. N.
The structure of the potassium salt of mu4-oxo-hexa-mu-chloro- tetra[chlorocuprate(II)], K4Cu4OCl10
Acta Crystallographica, Section B, 1972, 28, 3436-3437
9011130 CIFB5 H10 Na O13C 1 2/c 111.119; 16.474; 13.576
90; 112.83; 90
2291.96Merlino, S.; Sartori, F.
The crystal structure of sborgite, NaB5O6(OH)4*3H2O
Acta Crystallographica, Section B, 1972, 28, 3559-3567
9011131 CIFH0.886 O12.886 P3 Sr4.894P 63/m9.745; 9.745; 7.265
90; 90; 120
597.489Sudarsanan, K.; Young, R. A.
Structure of strontium hydroxide phosphate, Sr5(PO4)3OH Locality: synthetic
Acta Crystallographica, Section B, 1972, 28, 3668-3670
9011133 CIFCu3 S4 SbI -4 2 m5.385; 5.385; 10.754
90; 90; 90
311.847Garin, J.; Parthe, E.
The crystal structure of Cu3PSe4 and other ternary normal tetrahedral structure compounds with composition 1_356_4
Acta Crystallographica, Section B, 1972, 28, 3672-3674
9011134 CIFCu3 P Se4P m n 217.697; 6.661; 6.381
90; 90; 90
327.152Garin, J.; Parthe, E.
The crystal structure of Cu3PSe4 and other ternary normal tetrahedral structure compounds with composition 1_356_4
Acta Crystallographica, Section B, 1972, 28, 3672-3674
9011135 CIFAs Lu O4I 41/a m d :26.949; 6.949; 6.227
90; 90; 90
300.693Lohmuller, G.; Schmidt, G.; Deppisch, B.; Gramlich, V.; Scheringer, C.
Die kristallstrukturen von yttrium-vanadat, lutetium-phosphat und lutetium-arsenat Locality: synthetic Note: isostructural with Chernovite-(Y)
Acta Crystallographica, Section B, 1973, 29, 141-142
9011136 CIFLu O4 PI 41/a m d :26.792; 6.792; 5.955
90; 90; 90
274.712Lohmuller, G.; Schmidt, G.; Deppisch, B.; Gramlich, V.; Scheringer, C.
Die kristallstrukturen von yttrium-vanadat, lutetium-phosphat und lutetium-arsenat Locality: synthetic Note: isostructural with xenotime-(Y)
Acta Crystallographica, Section B, 1973, 29, 141-142
9011137 CIFO4 V YI 41/a m d :27.12; 7.12; 6.289
90; 90; 90
318.817Lohmuller, G.; Schmidt, G.; Deppisch, B.; Gramlich, V.; Scheringer, C.
Die kristallstrukturen von yttrium-vanadat, lutetium-phosphat und lutetium-arsenat Locality: synthetic
Acta Crystallographica, Section B, 1973, 29, 141-142
9011138 CIFCa O7 V3P n a m10.459; 5.295; 10.382
90; 90; 90
574.959Bouloux, J. C.; Galy, J.
Les hypovanadates MV3O7 (M=Ca,Sr,Cd). Structure cristalline de CaV3O7
Acta Crystallographica, Section B, 1973, 29, 269-275
9011139 CIFGaR -3 m :H9.087; 9.087; 17.02
90; 90; 120
1217.11Bosio, L.; Curien, H.; Dupont, M.; Rimsky, A.
Structure cristalline de Ga-delta Loclity: synthetic Sample: at T = 191 K Note: structure known as the delta phase
Acta Crystallographica, Section B, 1973, 29, 367-368
9011140 CIFCu O5 Te2P 1 21/c 16.871; 9.322; 7.602
90; 109.08; 90
460.169Hanke, K.; Kupcik, V.; Lindqvist, O.
The crystal structure of CuTe2O5
Acta Crystallographica, Section B, 1973, 29, 963-970
9011141 CIFO5 Te UP c a 2110.161; 5.363; 7.862
90; 90; 90
428.427Meunier, G.; Galy, J.
Structure cristalline de la schmitterite synthetique UTeO5
Acta Crystallographica, Section B, 1973, 29, 1251-1255
9011142 CIFCu5 O10 V2P 1 21/c 18.393; 6.0652; 16.156
90; 108.09; 90
781.772Shannon, R. D.; Calvo, C.
Crystal structure of Cu5V2O10
Acta Crystallographica, Section B, 1973, 29, 1338-1345
9011143 CIFAs Hg3 O4P 1 21/c 18.73; 5.08; 15.64
90; 128.4; 90
543.577Kamenar, B.; Kaitner, B.
The crystal structure of mercury(I) orthoarsenate
Acta Crystallographica, Section B, 1973, 29, 1666-1669
9011144 CIFCa4 O9 P2P 1 21 17.023; 11.986; 9.473
90; 90.9; 90
797.317Dickens, B.; Brown, W. E.; Kruger, G. J.; Stewart, J. M.
Ca4(PO4)2O, tetracalcium diphosphate monooxide. Crystal structure and relationships to Ca5(PO4)3OH and K3Na(SO4)2 Note: z(O11) corrected to match reported bond lengths
Acta Crystallographica, Section B, 1973, 29, 2046-2056
9011145 CIFCu9 Fe9 S16P -4 2 m10.585; 10.585; 5.383
90; 90; 90
603.123Hall, S. R.; Rowland, J. F.
The crystal structure of synthetic mooihoekite, Cu9Fe9S16
Acta Crystallographica, Section B, 1973, 29, 2365-2372
9011146 CIFNa O6 Sc Si2C 1 2/c 19.8438; 9.0439; 5.354
90; 107.215; 90
455.294Hawthorne, F. C.; Grundy, H. D.
Refinement of the crystal structure of NaScSi2O6
Acta Crystallographica, Section B, 1973, 29, 2615-2616
9011147 CIFH9 N Na O8 PP -110.636; 6.9187; 6.4359
90.46; 97.87; 109.2
442.331Ferraris, G.; Franchini-Angela M
Hydrogen bonding in the crystalline state. Crystal structure and twinning of NaNH4HPO4*4H2O (Stercorite)
Acta Crystallographica, Section B, 1974, 30, 504-510
9011148 CIFCl H4 Na O2P 1 21/c 16.3313; 10.1178; 6.5029
90; 114.407; 90
379.341Klewe, B.; Pedersen, B.
The crystal structure of sodium chloride dihydrate
Acta Crystallographica, Section B, 1974, 30, 2363-2371
9011149 CIFAl2.672 Ca0.82 H12 K O22 Si5.328P 1 21/m 19.865; 14.3; 8.668
90; 124.2; 90
1011.35Rinaldi, R.; Pluth, J. J.; Smith, J. V.
Zeolites of the phillipsite family. Refinement of the crystal structure of phillipsite and harmotome
Acta Crystallographica, Section B, 1974, 30, 2426-2433
9011150 CIFAl2.48 Ba Ca0.3 H12 O22 Si5.52P 1 21/m 19.879; 14.139; 8.693
90; 124.81; 90
996.944Rinaldi, R.; Pluth, J. J.; Smith, J. V.
Zeolites of the phillipsite family. Refinement of the crystal structure of phillipsite and harmotome
Acta Crystallographica, Section B, 1974, 30, 2426-2433
9011152 CIFH K O4 SP b c a8.412; 9.8; 18.957
90; 90; 90
1562.77Cotton, F. A.; Frenz, B. A.; Hunter, D. L.
The structure of potassium hydrogensulfate Note: y(O23), z(H1), x(H2) corrected
Acta Crystallographica, Section B, 1975, 31, 302-304
9011153 CIFC H2 Na2 O4P 21 a b6.472; 10.724; 5.259
90; 90; 90
365.005Wu, K. K.; Brown, I. D.
A neutron diffraction study of Na2CO3*H2O
Acta Crystallographica, Section B, 1975, 31, 890-892
9011154 CIFH8 O12 P2 Zn3P n m a10.629; 18.339; 5.04
90; 90; 90
982.423Whitaker, A.
The crystal structure of hopeite, Zn3(PO4)2*4H2O
Acta Crystallographica, Section B, 1975, 31, 2026-2035
9011155 CIFO9 S2 Sb2P 41 21 26.59; 6.59; 17.04
90; 90; 90
740.015Mercier, R.; Douglade, J.; Theobald, F. R.
Structure cristalline de Sb2O3*2SO3
Acta Crystallographica, Section B, 1975, 31, 2081-2085
9011156 CIFCu4 Fe5 S8P 2 2 210.705; 10.734; 31.63
90; 90; 90
3634.52Rowland, J. F.; Hall, S. R.
Haycockite, Cu4Fe5S8: a superstructure in the chalcopyrite series
Acta Crystallographica, Section B, 1975, 31, 2105-2112
9011157 CIFCu2.5 Fe0.5 S2P b c a10.95; 21.862; 10.95
90; 90; 90
2621.31Koto, K.; Morimoto, N.
Superstructure investigation of bornite, Cu5FeS4, by the modified partial Patterson function
Acta Crystallographica, Section B, 1975, 31, 2268-2273
9011158 CIFB5 H5 Na2 O11P n a 2112.015; 6.518; 11.173
90; 90; 90
875Corazza, E.; Menchetti, S.; Sabelli, C.
The crystal structure of nasinite, Na2[B5O8(OH)]*2H2O
Acta Crystallographica, Section B, 1975, 31, 2405-2410
9011159 CIFF3 LaP -3 c 17.185; 7.185; 7.351
90; 90; 120
328.648Cheetham, A. K.; Fender, B. E. F.; Fuess, H.; Wright, A. F.
A powder neutron diffraction study of lanthanum and cerium trifluorides Chem 5 (1966) 1466-1468
Acta Crystallographica, Section B, 1976, 32, 94-97
9011160 CIFCe F3P -3 c 17.131; 7.131; 7.286
90; 90; 120
320.864Cheetham, A. K.; Fender, B. E. F.; Fuess, H.; Wright, A. F.
A powder neutron diffraction study of lanthanum and cerium trifluorides
Acta Crystallographica, Section B, 1976, 32, 94-97
9011161 CIFCa9 H Mn O28 P7R 3 c :H10.438; 10.438; 37.15
90; 90; 120
3505.29Kostiner, E.; Rea, J. R.
The crystal structure of manganese-whitlockite, Ca18Mn2H2(PO4)14
Acta Crystallographica, Section B, 1976, 32, 250-253
9011162 CIFB7 Ba3 H4 Na O20 Si2C 1 2/c 114.639; 8.466; 13.438
90; 114.21; 90
1518.95Ghose, S.; Wan, C.; Ulbrich, H. H.
Structural chemistry of borosilicates. I. Garrelsite, NaBa3Si2B7O16(OH)4, a silicoborate with the pentaborate [B5O12]9- polyanion
Acta Crystallographica, Section B, 1976, 32, 824-832
9011163 CIFCu H12 N6 O6P n n m10.84; 23.693; 6.902
90; 90; 90
1772.66Morosin, B.
The crystal structure of copper(II) tetraammine nitrate
Acta Crystallographica, Section B, 1976, 32, 1237-1240
9011164 CIFFe6.34 Mn O38 Pb0.83 Ti13.66R -3 :R9.172; 9.172; 9.172
69.02; 69.02; 69.02
648.885Grey, I. E.; Lloyd, D. J.
The crystal structure of senaite
Acta Crystallographica, Section B, 1976, 32, 1509-1513
9011165 CIFO15 S2 Sb6C c c 212.073; 19.023; 5.876
90; 90; 90
1349.51Bovin, J. O.
The crystal structure of the antimony(III) oxide sulphate Sb6O7(SO4)2
Acta Crystallographica, Section B, 1976, 32, 1771-1777
9011166 CIFH K O4 SP b c a8.429; 9.807; 18.976
90; 90; 90
1568.62Payan, F.; Haser, R.
On the hydrogen bonding in potassium hydrogen sulphate. Comparison with a previous crystal structure determination
Acta Crystallographica, Section B, 1976, 32, 1875-1879
9011167 CIFO12 S3 Sb2P 1 21/c 113.12; 4.75; 17.55
90; 126.3; 90
881.457Mercier, R.; Douglade, J.; Bernard, J.
Structure cristalline de Sb2O3*3SO3
Acta Crystallographica, Section B, 1976, 32, 2787-2791
9011168 CIFH28 Mg3 N2 O24 P4P -110.728; 7.67; 6.702
97.87; 96.97; 104.74
521.225Catti, M.; Franchini-Angela M
Hydrogen bonding in the crystalline state. Structure of Mg3(NH4)2(HPO4)4*8H2O (hannayite), and crystal-chemical relationships with schertelite and struvite
Acta Crystallographica, Section B, 1976, 32, 2842-2848
9011169 CIFO2 SbP n a 215.456; 4.814; 11.787
90; 90; 90
309.588Thornton, G.
A neutron diffraction study of a-Sb2O4
Acta Crystallographica, Section B, 1977, 33, 1271-1273
9011170 CIFBR -3 m :H10.9251; 10.9251; 23.8143
90; 90; 120
2461.61Callmer, B.
An accurate refinement of the beta-rhombohedral boron structure
Acta Crystallographica, Section B, 1977, 33, 1951-1954
9011171 CIFAs Cu2 H O5P 21/n 1 18.615; 8.24; 5.953
90; 90; 90
422.589Toman, K.
The symmetry and crystal structure of olivenite Sample: alpha = .23
Acta Crystallographica, Section B, 1977, 33, 2628-2631
9011172 CIFAs Cu2 H O5P 21/n 1 18.615; 8.24; 5.953
90; 90; 90
422.589Toman, K.
The symmetry and crystal structure of olivenite Sample: alpha = .00
Acta Crystallographica, Section B, 1977, 33, 2628-2631
9011173 CIFCa Cl FP 4/n m m :23.894; 3.894; 6.818
90; 90; 90
103.383Liebich, W.; Nicollin, D.
Refinement of the PbFCl types BaFI, BaFBr and CaFCl Note: matlockite structure
Acta Crystallographica, Section B, 1977, 33, 2790-2794
9011174 CIFBa Br FP 4/n m m :24.508; 4.508; 7.441
90; 90; 90
151.216Liebich, W.; Nicollin, D.
Refinement of the PbFCl types BaFI, BaFBr and CaFCl Note: matlockite structure
Acta Crystallographica, Section B, 1977, 33, 2790-2794
9011175 CIFBa F IP 4/n m m :24.654; 4.654; 7.962
90; 90; 90
172.455Liebich, W.; Nicollin, D.
Refinement of the PbFCl types BaFI, BaFBr and CaFCl Note: matlockite structure
Acta Crystallographica, Section B, 1977, 33, 2790-2794
9011177 CIFAl1.42 Ba0.39 Ca0.01 K0.43 Na0.17 O8 Si2.58C 1 2/m 18.557; 13.04; 7.2
90; 115.69; 90
723.986De Pieri, R.; Quareni, S.; Hall, K. M.
Refinement of the structures of low and high hyalophanes Sample: Low hyalophane
Acta Crystallographica, Section B, 1977, 33, 3073-3076
9011178 CIFAl1.42 Ba0.39 Ca0.01 K0.43 Na0.17 O8 Si2.58C 1 2/m 18.556; 13.045; 7.189
90; 115.63; 90
723.436De Pieri, R.; Quareni, S.; Hall, K. M.
Refinement of the structures of low and high hyalophanes Sample: High hyalophane
Acta Crystallographica, Section B, 1977, 33, 3073-3076
9011179 CIFH5 Na2 O6 PP b c a16.872; 10.359; 6.599
90; 90; 90
1153.35Catti, M.; Ferraris, G.; Franchini-Angela M
The crystal structure of Na2HPO4*2H2O. Competition between coordination and hydrogen bonds Locality: synthetic Note: displacement parameters from ICSD, Biso(H1) invented
Acta Crystallographica, Section B, 1977, 33, 3449-3452
9011180 CIFAl B O3R -3 c :H4.4638; 4.4638; 13.745
90; 90; 120
237.184Vegas, A.; Cano, F. H.; Garcia-Blanco S
Refinement of aluminium orthoborate Sample: 0-50 degree reflections Note: calcite structure type
Acta Crystallographica, Section B, 1977, 33, 3607-3609
9011181 CIFAl B O3R -3 c :H4.4638; 4.4638; 13.745
90; 90; 120
237.184Vegas, A.; Cano, F. H.; Garcia-Blanco S
Refinement of aluminium orthoborate Sample: 0-50 degree reflections, Al3+, O- Note: calcite structure type
Acta Crystallographica, Section B, 1977, 33, 3607-3609
9011182 CIFAl B O3R -3 c :H4.4638; 4.4638; 13.745
90; 90; 120
237.184Vegas, A.; Cano, F. H.; Garcia-Blanco S
Refinement of aluminium orthoborate Sample: 0-30 degree reflections Note: calcite structure type
Acta Crystallographica, Section B, 1977, 33, 3607-3609
9011183 CIFAl B O3R -3 c :H4.4638; 4.4638; 13.745
90; 90; 120
237.184Vegas, A.; Cano, F. H.; Garcia-Blanco S
Refinement of aluminium orthoborate Sample: 0-30 degree reflections, Al3+, O- Note: calcite structure type
Acta Crystallographica, Section B, 1977, 33, 3607-3609
9011184 CIFAl B O3R -3 c :H4.4638; 4.4638; 13.745
90; 90; 120
237.184Vegas, A.; Cano, F. H.; Garcia-Blanco S
Refinement of aluminium orthoborate Sample: 30-50 degree reflections Note: calcite structure type
Acta Crystallographica, Section B, 1977, 33, 3607-3609
9011185 CIFAl B O3R -3 c :H4.4638; 4.4638; 13.745
90; 90; 120
237.184Vegas, A.; Cano, F. H.; Garcia-Blanco S
Refinement of aluminium orthoborate Sample: 30-50 degree reflections, Al3+, O- Note: calcite structure type
Acta Crystallographica, Section B, 1977, 33, 3607-3609
9011186 CIFCa I2 O6P 1 21/n 17.1432; 11.297; 7.2804
90; 106.35; 90
563.746Ghose, S.; Wan, C.
The crystal structure of synthetic lautarite, Ca(IO3)2 Note: Biso(O1) corrected
Acta Crystallographica, Section B, 1978, 34, 84-88
9011187 CIFFe Na O8 Ti3C 1 2/m 112.267; 3.823; 6.483
90; 107.16; 90
290.497Ishiguro, T.; Tanaka, K.; Marumo, F.; Ismail, M. G. M. U.; Hirano, S.; Somiya, S.
Freudenbergite Note: anisoU's from ICSD
Acta Crystallographica, Section B, 1978, 34, 255-256
9011188 CIFAs Cu0.86 H O5 Zn1.14P n n m8.5; 8.52; 5.99
90; 90; 90
433.796Toman, K.
Ordering in olivenite-adamite solid solutions
Acta Crystallographica, Section B, 1978, 34, 715-721
9011189 CIFNa2 O5 Si TiP 4/n m m :16.48; 6.48; 5.107
90; 90; 90
214.445Nyman, H.; O'Keeffe M; Bovin, J. O.
Sodium titanium silicate, Na2TiSiO5 Note: anisoU's from ICSD
Acta Crystallographica, Section B, 1978, 34, 905-906
9011190 CIFO3 Pb TiP 4 m m3.895; 3.895; 4.171
90; 90; 90
63.278Glazer, A. M.; Mabud, S. A.
Powder profile refinement of lead zirconate titanate at several temperatures. II. Pure PbTiO3 Locality: synthetic Sample: T = -183 C
Acta Crystallographica, Section B, 1978, 34, 1065-1070
9011191 CIFO3 Pb TiP 4 m m3.899; 3.899; 4.167
90; 90; 90
63.348Glazer, A. M.; Mabud, S. A.
Powder profile refinement of lead zirconate titanate at several temperatures. II. Pure PbTiO3 Locality: synthetic Sample; T = -115 C
Acta Crystallographica, Section B, 1978, 34, 1065-1070
9011192 CIFO3 Pb TiP 4 m m3.905; 3.905; 4.156
90; 90; 90
63.375Glazer, A. M.; Mabud, S. A.
Powder profile refinement of lead zirconate titanate at several temperatures. II. Pure PbTiO3 Locality: synthetic Sample: T = 25 C
Acta Crystallographica, Section B, 1978, 34, 1065-1070
9011193 CIFO3 Pb TiP 4/m m m3.97; 3.97; 3.97
90; 90; 90
62.571Glazer, A. M.; Mabud, S. A.
Powder profile refinement of lead zirconate titanate at several temperatures. II. Pure PbTiO3 Locality: synthetic Sample: T = 550 C
Acta Crystallographica, Section B, 1978, 34, 1065-1070
9011194 CIFO5 Te UP b c m5.363; 10.161; 7.862
90; 90; 90
428.427Loopstra, B. O.; Brandenburg, N. P.
Uranyl selenite and uranyl tellurite
Acta Crystallographica, Section B, 1978, 34, 1335-1337
9011195 CIFO5 Se UP 1 21/m 15.408; 9.278; 4.2545
90; 93.45; 90
213.084Loopstra, B. O.; Brandenburg, N. P.
Uranyl selenite and uranyl tellurite
Acta Crystallographica, Section B, 1978, 34, 1335-1337
9011196 CIFCa O10 S6 Sb10C 1 2/c 125.37; 5.654; 16.87
90; 117.58; 90
2144.89Nakai, I.; Nagashima, K.; Koto, K.; Morimoto, N.
Crystal structure of oxide-chalcogenide. I.The crystal stucture of sarabauite CaSb10O10S6 Locality: Sarabau mine, Sarawak, Malaysia
Acta Crystallographica, Section B, 1978, 34, 3569-3572
9011197 CIFMnP 41 3 26.315; 6.315; 6.315
90; 90; 90
251.837Shoemaker, C. B.; Shoemaker, D. P.; Hopkins, T. E.; Yindepit, S.
Refinement of the structure of beta-manganese and of related phase in the Mn-Ni-Si system
Acta Crystallographica, Section B, 1978, 34, 3573-3576
9011198 CIFMn3.28 Ni1.01 Si0.71P 21 36.292; 6.292; 6.292
90; 90; 90
249.096Shoemaker, C. B.; Shoemaker, D. P.; Hopkins, T. E.; Yindepit, S.
Refinement of the structure of beta-manganese and of related phase in the Mn-Ni-Si system
Acta Crystallographica, Section B, 1978, 34, 3573-3576
9011199 CIFH12 K Mg O10 PP m n 216.873; 6.16; 11.087
90; 90; 90
469.398Mathew, M.; Schroeder, L. W.
Crystal structure of a struvite analogue, MgKPO4*6H2O
Acta Crystallographica, Section B, 1979, 35, 11-13
9011200 CIFAl0.92 Ca0.43 Na0.07 O4 Si1.08I -18.183; 12.883; 14.186
93.38; 115.87; 90.82
1341.96Facchinelli, A.; Bruno, E.; Chiari, G.
The structure of bytownite quenched from 1723 K Locality: satellite dyke, Traversella stock, Sesia Lanzo zone, Western Alps, Italy Sample: non-split model Note: T and O anisoB's from ICSD
Acta Crystallographica, Section B, 1979, 35, 34-42
9011201 CIFAl7.76 Ca3.44 Na0.56 O32 Si8.24P -18.183; 12.883; 14.186
93.38; 115.87; 90.82
1341.96Facchinelli, A.; Bruno, E.; Chiari, G.
The structure of bytownite quenched from 1723 K Locality: satellite dyke, Traversella stock, Sesia Lanzo zone, Western Alps, Italy Sample: BytQ, P-1 model
Acta Crystallographica, Section B, 1979, 35, 34-42
9011202 CIFBi54 Pb46 S127P 1 21/m 1189.8; 4.09; 74.06
90; 11.93; 90
11884.4Matzat, E.
Cannizzarite Locality: Vulcano, Italy
Acta Crystallographica, Section B, 1979, 35, 133-136
9011203 CIFBi4 Te3R -3 m :H4.451; 4.451; 41.888
90; 90; 120
718.68Yamana, K.; Kihara, K.; Matsumoto, T.
Bismuth tellurides: BiTe and Bi4Te3 Note: anisoB's from ICSD
Acta Crystallographica, Section B, 1979, 35, 147-149
9011204 CIFBi TeP -3 m 14.423; 4.423; 24.002
90; 90; 120
406.642Yamana, K.; Kihara, K.; Matsumoto, T.
Bismuth tellurides: BiTe and Bi4Te3 Note: anisoB's from ICSD
Acta Crystallographica, Section B, 1979, 35, 147-149
9011205 CIFO5 Sb2C 1 2/c 112.646; 4.782; 5.4247
90; 103.91; 90
318.429Jansen, M.
Die kristallstruktur von antimon(V)-oxid
Acta Crystallographica, Section B, 1979, 35, 539-542
9011206 CIFH O5 Pb V ZnP n m a7.593; 6.057; 9.416
90; 90; 90
433.049Hawthorne, F. C.; Faggiani, R.
Refinement of the structure of descloizite Note: anisoB's from ICSD
Acta Crystallographica, Section B, 1979, 35, 717-720
9011207 CIFH12 Mg N2 O12P 1 21/c 16.194; 12.707; 6.6
90; 92.99; 90
518.76Braibanti, A.; Tiripicchio, A.; Lanfredi, A. M. M.; Bigoli, F.
The crystal structures of nitrates of divalent hexaquocations. II. Hexaquomagnesium nitrate Note: z(Wat2) corrected
Acta Crystallographica, Section B, 1979, 35, 354-361
9011208 CIFO21 S6 Sb2P -16.644; 12.39; 9.678
92.69; 82.29; 96.88
783.412Douglade, J.; Mercier, R.
Structure cristalline du disulfate d'antimoine(III) Sb2(S2O7)3
Acta Crystallographica, Section B, 1979, 35, 1062-1067
9011209 CIFH10 O10 S VP 1 21/c 16.976; 9.716; 12.902
90; 110.9; 90
816.945Tachez, M.; Theobald, F. R.; Watson, K. J.; Mercier, R.
Redetermination de la structure du sulfate de vanadyle pentahydrate VOSO4*5H2O Locality: synthetic Note: anisoB's from ICSD
Acta Crystallographica, Section B, 1979, 35, 1545-1550
9011210 CIFAl2 O30 P2 U3P 1 21/a 113.836; 20.918; 9.428
90; 112.44; 90
2522.05Piret, P.; Piret-Meunier J; Declercq, J. P.
Structure of phuralumite
Acta Crystallographica, Section B, 1979, 35, 1880-1882
9011211 CIFCu Fe0.5 S4 Sn1.5I 41/a :17.305; 7.305; 10.33
90; 90; 90
551.24Jumas, J. C.; Philippot, E.; Maurin, M.
Structure du rhodostannite synthetique
Acta Crystallographica, Section B, 1979, 35, 2195-2197
9011213 CIFBi2 Hg S4C 1 2/m 114.17; 4.06; 13.99
90; 118.27; 90
708.85Mumme, W. G.; Watts, J. A.
HgBi2S4: Crystal structure and relationship with the pavonite homologous series Locality: synthetic
Acta Crystallographica, Section B, 1980, 36, 1300-1304
9011214 CIFAs O4 SbP 1 21/m 14.794; 6.925; 5.307
90; 93.55; 90
175.846Jones, P. G.; Sheldrick, G. M.; Schwarzmann, E.
Antimony(III) arsenic(V) oxide
Acta Crystallographica, Section B, 1980, 36, 1923-1925
9011215 CIFC4 H4 Cu Na2 O10P -13.583; 9.649; 7.549
109.07; 76.38; 103.32
236.358Chananont, P.; Nixon, P. E.; Waters, J. M.; Water, T. N.
The structure of disodium catena-bis(mu-oxalato)-cuprate(II) dihydrate
Acta Crystallographica, Section B, 1980, 36, 2145-2147
9011216 CIFO2 PbP 42/m n m4.9578; 4.9578; 3.3878
90; 90; 90
83.271D'Antonio P; Santoro, A.
Powder neutron diffraction study of chemically prepared B-lead dioxide
Acta Crystallographica, Section B, 1980, 36, 2394-2397
9011217 CIFO SnP 4/n m m :13.8029; 3.8029; 4.8382
90; 90; 90
69.97Pannetier, J.; Denes, G.
Tin(II) oxide: structure refinement and thermal expansion
Acta Crystallographica, Section B, 1980, 36, 2763-2765
9011218 CIFN2P m -3 n6.164; 6.164; 6.164
90; 90; 90
234.201Cromer, D. T.; Mills, R. L.; Schiferl, D.; Schwalbe, L. A.
The structure of N2 at 49 kbar and 299 K Sample: at T = 299 K and P = 4.9 GPa Note: model #4
Acta Crystallographica, Section B, 1981, 37, 8-11
9011219 CIFBr1.012 Ca4.922 O11.965 P2.896P 63/m9.761; 9.761; 6.739
90; 90; 120
556.051Elliott, J. C.; Dykes, E.; Mackie, P. E.
Structure of bromapatite and the radius of the bromide ion
Acta Crystallographica, Section B, 1981, 37, 435-438
9011220 CIFCa11 O18 S Si4I -4 m 210.461; 10.461; 8.813
90; 90; 90
964.429Dent Glasser, L. S.; Lee, C. K.
The structure of jasmundite, Ca22(SiO4)8O4S2 Locality: Ettringer Feld lava flow, Bellerberg volcano, Mayen, Eifel, Germany
Acta Crystallographica, Section B, 1981, 37, 803-806
9011221 CIFC2 Na2 O4P 1 21/c 13.449; 5.243; 10.375
90; 92.66; 90
187.41Reed, D. A.; Olmstead, M. M.
Sodium oxalate structure refinement Sample: T = 140 K
Acta Crystallographica, Section B, 1981, 37, 938-939
9011222 CIFCa O3 SiC -16.853; 11.895; 19.674
90.12; 90.55; 90
1603.68Yamanaka, T.; Mori, H.
The structure and polytypes of alpha-W CaSiO3 (pseudowollastonite)
Acta Crystallographica, Section B, 1981, 37, 1010-1017
9011223 CIFAs3 Fe3 H24 O26 Zn2C 1 m 111.415; 11.259; 8.661
90; 107.74; 90
1060.19Ginderow, D.; Cesbron, F.
Structure de la mapimite, Zn2Fe3(AsO4)3(OH)4*10H2O Note: anisoB's from ICSD
Acta Crystallographica, Section B, 1981, 37, 1040-1043
9011224 CIFC2 H10 Mg0.773 Mn3.684 O16 Zn2.543A 1 2/a 116.408; 5.54; 15.15
90; 95.48; 90
1370.85Hill, R. J.
The structure of loseyite Note: AnisoU's from ICSD
Acta Crystallographica, Section B, 1981, 37, 1323-1328
9011225 CIFAs3 Fe H10 O17P 1 21/n 115.25; 19.6; 4.72
90; 91.8; 90
1410.11Boudjada, A.; Guitel, J. C.
Structure cristalline d'un orthoarseniate acide de fer(III) pentahydrate: Fe(H2AsO4)3*5H2O Locality: synthetic Note: anisoB's from ICSD
Acta Crystallographica, Section B, 1981, 37, 1402-1405
9011226 CIFAs0.185 Ca0.192 Fe0.348 H Mn5.772 O19 Si5 V0.815P 1 21/n 16.712; 28.948; 7.578
90; 95.4; 90
1465.86Gramaccioli, C. M.; Liborio, G.; Pilati, T.
Structure of medaite, Mn6[VSi5O18(OH)]: The presence of a new kind of heteropolysilicate anion Note: anisoB's from ICSD
Acta Crystallographica, Section B, 1981, 37, 1972-1978
9011227 CIFB Cl H4 Na2 O4P 4/n m m :27.26; 7.26; 4.847
90; 90; 90
255.474Effenberger, H.
Verfeinerung der kristallstruktur von synthetischem teepleit
Acta Crystallographica, Section B, 1982, 38, 82-85
9011228 CIFAl13 Cl F4 H14 O34 Si5F -4 3 m13.8654; 13.8654; 13.8654
90; 90; 90
2665.61Baur, W. H.; Ohta, T.
The Si5O16 pentamer in zunyite refined and empirical relations for individual silicon-oxygen bonds Locality: Quartzsite, Arizona, USA
Acta Crystallographica, Section B, 1982, 38, 390-401
9011229 CIFAl13.25 Cl F4 H14 O34 Si4.75F -4 3 m13.8796; 13.8796; 13.8796
90; 90; 90
2673.81Baur, W. H.; Ohta, T.
The Si5O16 pentamer in zunyite refined and empirical relations for individual silicon-oxygen bonds Locality: Zuni Mine, Colorado, USA Sample: M9003
Acta Crystallographica, Section B, 1982, 38, 390-401
9011230 CIFAs2 O12 S3P 1 21/c 19.389; 5.255; 19.355
90; 91.88; 90
954.446Douglade, J.; Mercier, R.
Structure cristalline et covalence des liaisons dans le sulfate d'arsenic(III), As2(SO4)3 Note: anisoB's from ICSD
Acta Crystallographica, Section B, 1982, 38, 720-723
9011231 CIFAs2 O6 SP 21 21 24.628; 11.497; 4.776
90; 90; 90
254.122Mercier, R.; Douglade, J.
Affinement de la structure avec tunnels de paires E dans un oxysulfate d'arsenic: (As2O2)(SO4)
Acta Crystallographica, Section B, 1982, 38, 896-898
9011232 CIFC4 H16 Co N4 Na2 O8 S4P 1 21/n 118.941; 19.209; 5.46
90; 91.64; 90
1985.74Mereiter, K.; Preisinger, A.
The structure of sodium tetraisothiocyanatocobaltate(II) octahydrate Na2[Co(NCS)4]*8H2O Locality: synthetic
Acta Crystallographica, Section B, 1982, 38, 1084-1088
9011233 CIFCu3 O8 V2P -15.196; 5.355; 6.505
69.22; 88.69; 68.08
155.733Coing-Boyat J
Structure de la variete ordinaire, triclinique, de l'orthovanadate de cuivre(II), Cu3(VO4)2
Acta Crystallographica, Section B, 1982, 38, 1546-1548
9011234 CIFAs Bi O4P 1 21/n 16.879; 7.159; 6.732
90; 104.84; 90
320.471Bedlivy, D.; Mereiter, K.
Structure of alpha-BiAsO4 (rooseveltite) Note: AnisoU's from ICSD
Acta Crystallographica, Section B, 1982, 38, 1559-1561
9011235 CIFAs2 O9 S2P 1 c 16.65; 6.671; 16.612
90; 94.34; 90
734.831Mercier, R.; Douglade, J.
Structure cristalline d'un oxysulfate d'arsenic(III) As2O(SO4)2 (ou As2O3*(SO3)2) Note: AnisoB's from ICSD
Acta Crystallographica, Section B, 1982, 38, 1731-1735
9011236 CIFS3 Sn2P n m a8.878; 3.751; 14.02
90; 90; 90
466.885Kniep, R.; Mootz, D.; Severin, U.; Wunderlich, H.
Structure of tin(II) tin(IV) trisulphide, a redetermination
Acta Crystallographica, Section B, 1982, 38, 2022-2023
9011237 CIFBi H3 O6 SP 1 21/n 16.021; 13.363; 6.495
90; 112.94; 90
481.25Graunar, M.; Lazarini, F.
Di-mu-hydroxo-bis[aquasulfatobismuth(III)] Locality: synthetic
Acta Crystallographica, Section B, 1982, 38, 2879-2881
9011238 CIFBi2 H2 O7 SP 1 21/c 17.692; 13.87; 5.688
90; 109.01; 90
573.745Golic, L.; Graunar, M.; Lazarini, F.
catena-Di-mu-hydroxo-mu3-oxo-dibismuth(III) sulfate
Acta Crystallographica, Section B, 1982, 38, 2881-2883
9011239 CIFAs2 Ca3 H22 O19P -112.563; 12.181; 6.205
88.94; 91.67; 113.44
870.796Catti, M.; Ivaldi, G.
On the topotactic dehydration Ca3(AsO4)2*11H2O (phaunouxite) -> Ca3(AsO4)2*10H2O (rauenthalite), and the structures of both minerals
Acta Crystallographica, Section B, 1983, 39, 4-10
9011240 CIFAs2 Ca3 H20 O18P -112.564; 12.169; 6.195
89.09; 79.69; 118.58
812.654Catti, M.; Ivaldi, G.
On the topotactic dehydration Ca3(AsO4)2*11H2O (phaunouxite) -> Ca3(AsO4)2*10H2O (rauenthalite), and the structures of both minerals
Acta Crystallographica, Section B, 1983, 39, 4-10
9011241 CIFNa O3 VP n m a14.147; 3.6496; 5.364
90; 90; 90
276.948Kato, K.; Takayama, E.
Das entwaesserungsverhalten des natriummetavanadatdihydrats und die kristallstruktur des beta-natriummetavanadats Note: anisoB's corrected from ICSD
Acta Crystallographica, Section B, 1984, 40, 102-105
9011242 CIFC2 Cu Na2 O6P 1 21/a 16.17; 8.171; 5.648
90; 116.24; 90
255.401Maslen, E. N.; Spadaccini, N.; Watson, K. J.
Electron density in non-ideal metal complexes. II. Sodium bis(carbonato)cuprate(II)
Acta Crystallographica, Section B, 1986, 42, 430-436
9011243 CIFH12 Ni O10 SP 41 21 26.783; 6.783; 18.288
90; 90; 90
841.414Stadnicka, K.; Glazer, A. M.; Koralewski, M.
Structure, absolute configuration and optical activity of alpha-nickel sulfate hexahydrate Locality: synthetic Note: y(O3) corrected to match reported bond lengths
Acta Crystallographica, Section B, 1987, 43, 319-325
9011244 CIFC10 H22 O3F d d 218.421; 22.791; 10.912
90; 90; 90
4581.22Marsh, E. R.; Herbstein, F. H.
More space group changes
Acta Crystallographica, Section B: Structural Science, 1988, 44, 77-88
9011245 CIFC3 NF d d 213.635; 26.353; 6.089
89.87; 90; 90
2187.91Marsh, R. E.; Herbstein, F. H.
More space group changes
Acta Crystallographica, Section B: Structural Science, 1988, 44, 77-88
9011246 CIFC7 H10 S2F d d 211.419; 41.077; 6.626
90; 90; 90
3107.98Marsh, R. E.; Herbstein, F. H.
More space group changes
Acta Crystallographica, Section B: Structural Science, 1988, 44, 77-88
9011247 CIFC11 H8 Ce N18 O19C 1 2/c 116.05; 13.14; 16.631
90; 108.1; 90
3333.86Marsh, R. E.; Herbstein, F. H.
More space group changes
Acta Crystallographica, Section B: Structural Science, 1988, 44, 77-88
9011248 CIFC19 H9P 1 21/a 131.276; 3.7818; 21.663
90; 124.22; 90
2118.72Marsh, R. E.; Herbstein, F. H.
More space group changes
Acta Crystallographica, Section B: Structural Science, 1988, 44, 77-88
9011249 CIFAs2 O9 S2P 1 21/c 16.65; 6.671; 16.612
90; 94.34; 90
734.831Marsh, R. E.; Herbstein, F. H.
More space-group changes
Acta Crystallographica, Section B: Structural Science, 1988, 44, 77-88
9011250 CIFF7 Ho2 KC 1 2/m 114.287; 8.004; 11.95
90; 125.33; 90
1114.85Marsh, R. E.; Herbstein, F. H.
More space-group changes
Acta Crystallographica, Section B: Structural Science, 1988, 44, 77-88
9011251 CIFC16 N OC 1 2/c 124.28; 8.76; 14.03
90; 108; 90
2838.03Marsh, R. E.; Herbstein, F. H.
More space-group changes
Acta Crystallographica, Section B: Structural Science, 1988, 44, 77-88
9011252 CIFAs3 Cd2 IC 1 2/c 18.436; 9.594; 7.952
90; 100.65; 90
632.509Marsh, R. E.; Herbstein, F. H.
More space-group changes
Acta Crystallographica, Section B: Structural Science, 1988, 44, 77-88
9011253 CIFC2 Br2 O TlC m c m10.31; 8.56; 15.55
90; 90; 90
1372.34Marsh, R. E.; Herbstein, F. H.
More space-group changes
Acta Crystallographica, Section B: Structural Science, 1988, 44, 77-88
9011254 CIFC12 Cl3 Cr2 F2 N8 O14P -110.71; 9.047; 8.785
111.25; 100.44; 86.6
780.18Marsh, R. E.; Herbstein, F. H.
More space-group changes
Acta Crystallographica, Section B: Structural Science, 1988, 44, 77-88
9011255 CIFC6 I SP n a m18.038; 6.611; 7.42
90; 90; 90
884.829Marsh, R. E.; Herbstein, F. H.
More space-group changes
Acta Crystallographica, Section B: Structural Science, 1988, 44, 77-88
9011256 CIFC24 H2 N2 O5C 1 2/c 118.943; 11.318; 24.376
90; 94.5; 90
5210.03Marsh, R. E.; Herbstein, F. H.
More space-group changes
Acta Crystallographica, Section B: Structural Science, 1988, 44, 77-88
9011257 CIFEr2 F7 KP n a m11.82; 13.333; 7.816
90; 90; 90
1231.77Marsh, R. E.; Herbstein, F. H.
More space-group changes
Acta Crystallographica, Section B: Structural Science, 1988, 44, 77-88
9011258 CIFAg0.1 Au0.9 Te2C 1 2/m 17.1947; 4.4146; 5.0703
90; 90.038; 90
161.041Schutte, W. J.; de Boer, J. L.
Valence fluctuations in the incommensurately modulated structure of calaverite AuTe2 Locality: Cripple Creek, Colorado Sample: T = 298 K
Acta Crystallographica, Section B, 1988, 44, 486-494
9011259 CIFAg0.1 Au0.9 Te2C 1 2/m 17.182; 4.402; 5.056
90; 89.99; 90
159.846Schutte, W. J.; de Boer, J. L.
Valence fluctuations in the incommensurately modulated structure of calaverite AuTe2 Locality: Cripple Creek, Colorado Sample: T = 100 K
Acta Crystallographica, Section B, 1988, 44, 486-494
9011260 CIFMg2 O4 TiP 41 2 25.9748; 5.9748; 8.414
90; 90; 90
300.365Wechsler, B. A.; Von Dreele, R. B.
Structure refinements of Mg2TiO4, MgTiO3 and MgTi2O5 by time-of-flight neutron powder diffraction Locality: synthetic Sample: T = 773 K
Acta Crystallographica, Section B, 1989, 45, 542-549
9011261 CIFMg O3 TiR -3 :H5.05478; 5.05478; 13.8992
90; 90; 120
307.557Wechsler, B. A.; Von Dreele, R. B.
Structure refinements of Mg2TiO4, MgTiO3 and MgTi2O5 by time-of-flight neutron powder diffraction Locality: synthetic
Acta Crystallographica, Section B, 1989, 45, 542-549
9011262 CIFMg0.999 O5 Ti2.001B b m m9.7289; 10.0057; 3.7416
90; 90; 90
364.224Wechsler, B. A.; Von Dreele, R. B.
Structure refinements of Mg2TiO4, MgTiO3 and MgTi2O5 by time-of-flight neutron powder diffraction Locality: synthetic Sample: T = 973 K
Acta Crystallographica, Section B, 1989, 45, 542-549
9011263 CIFMg O5 Ti2B b m m9.7492; 9.9896; 3.746
90; 90; 90
364.825Wechsler, B. A.; Von Dreele, R. B.
Structure refinements of Mg2TiO4, MgTiO3 and MgTi2O5 by time-of-flight neutron powder diffraction Locality: synthetic Sample: T = 1773
Acta Crystallographica, Section B, 1989, 45, 542-549
9011264 CIFD12 Ni O10 SP 43 21 26.7803; 6.7803; 18.288
90; 90; 90
840.744McIntyre, G. J.; Ptasiewicz-Bak H; Olovsson, I.
Bonding deformation and superposition effects in the electron density of tetragonal nickel sulfate hexadeuterate NiSO4*6D2O Sample: neutron refinement Note: anisoU's from ICSD
Acta Crystallographica, Section B, 1990, 46, 27-39
9011265 CIFH12 Ni O10 SP 43 21 26.7803; 6.7803; 18.288
90; 90; 90
840.744McIntyre, G. J.; Ptasiewicz-Bak H; Olovsson, I.
Bonding deformation and superposition effects in the electron density of tetragonal nickel sulfate hexadeuterate NiSO4*6D2O Sample: X-ray refinement
Acta Crystallographica, Section B, 1990, 46, 27-39
9011266 CIFCa4 H120 Na3 O252 Si85P n m a20.078; 19.894; 13.372
90; 90; 90
5341.2van Koningsveld, H.
High-temperature (350 K) orthorhombic framework structure of zeolite H-ZSM-5 Note: anisotropic thermal parameters obtained from ICSD
Acta Crystallographica, Section B, 1990, 46, 731-735
9011267 CIFC14 H10P 1 21 18.441; 6.14; 9.438
90; 97.96; 90
484.437Petricek, V.; Cisarova, I.; Hummel, L.; Kroupa, J.; Brezina, B.
Oriental disorder in phenanthrene. Structure determination at 248, 295, 339 and 344 K Locality: synthetic
Acta Crystallographica, Section B, 1990, 46, 830-832
9011268 CIFBi12.5 Fe0.5 O19.48I 2 310.184; 10.184; 10.184
90; 90; 90
1056.22Radaev, S. F.; Muradyan, L. A.; Simonov, V. I.
Atomic structure and crystal chemistry of sillenites: Bi12(Bi3+0.50Fe3+0.50)O19.50 and Bi12(Bi3+0.50Fe3+0.50)O19.33 Note: anisoB's from ICSD
Acta Crystallographica, Section B, 1991, 47, 1-6
9011269 CIFBi12.672 O19.32 Zn0.33I 2 310.207; 10.207; 10.207
90; 90; 90
1063.39Radaev, S. F.; Muradyan, L. A.; Simonov, V. I.
Atomic structure and crystal chemistry of sillenites: Bi12(Bi3+0.50Fe3+0.50)O19.50 and Bi12(Bi3+0.50Fe3+0.50)O19.33 Note: anisoB's from ICSD Note: z(Bi) corrected
Acta Crystallographica, Section B, 1991, 47, 1-6
9011270 CIFAl11 Na1.221 O17.111P 63/m m c5.5929; 5.5929; 22.526
90; 90; 120
610.223Edstrom, K.; Thomas, J. O.; Farrington, G. C.
Structural aspects of the Na+ -> Cd2+ ion-exchange process in Na+ beta-alumina Locality: synthetic Sample: y = 0 Note: anisoB's from ICSD
Acta Crystallographica, Section B, 1991, 47, 635-643
9011271 CIFAl11 Cd0.105 Na1.008 O17.111P 63/m m c5.5921; 5.5921; 22.526
90; 90; 120
610.049Edstrom, K.; Thomas, J. O.; Farrington, G. C.
Structural aspects of the Na+ -> Cd2+ ion-exchange process in Na+ beta-alumina Locality: synthetic Sample: y = .21 Note: anisoB's from ICSD
Acta Crystallographica, Section B, 1991, 47, 635-643
9011272 CIFAl11 Cd0.222 Na0.774 O17.111P 63/m m c5.5906; 5.5906; 22.519
90; 90; 120
609.532Edstrom, K.; Thomas, J. O.; Farrington, G. C.
Structural aspects of the Na+ -> Cd2+ ion-exchange process in Na+ beta-alumina Locality: synthetic Note: anisoB's from ICSD Sample: y = .45
Acta Crystallographica, Section B, 1991, 47, 635-643
9011273 CIFAl11 Cd0.615 O17.111P 63/m m c5.5869; 5.5869; 22.37
90; 90; 120
604.698Edstrom, K.; Thomas, J. O.; Farrington, G. C.
Structural aspects of the Na+ -> Cd2+ ion-exchange process in Na+ beta-alumina Note: anisoB's from ICSD Sample: y = 1.22
Acta Crystallographica, Section B, 1991, 47, 635-643
9011274 CIFK O5 P TiP n a 2112.8209; 6.4052; 10.5932
90; 90; 90
869.918Hansen, N. K.; Protas, J.; Marnier, G.
The electron-density distribution in KTiOPO4
Acta Crystallographica, Section B, 1991, 47, 660-672
9011275 CIFAg Cu SC m c 214.059; 6.617; 7.967
90; 90; 90
213.981Baker, C. L.; Lincoln, F. J.; Johnson, A. W. S.
A low-temperature structural phase transformation in CuAgS Sample: T = 298 K
Acta Crystallographica, Section B, 1991, 47, 891-899
9011276 CIFAg Cu SP m c 214.047; 6.592; 7.93
90; 90; 90
211.555Baker, C. L.; Lincoln, F. J.; Johnson, A. W. S.
A low-temperature structural phase transformation in CuAgS Sample: T = 120 K Note: dimorphic with stromeyerite
Acta Crystallographica, Section B, 1991, 47, 891-899
9011277 CIFAg Cu SP m c 214.0431; 6.591; 7.9149
90; 90; 90
210.917Baker, C. L.; Lincoln, F. J.; Johnson, A. W. S.
A low-temperature structural phase transformation in CuAgS Sample: T = 13 K Note: dimorphic with stromeyerite
Acta Crystallographica, Section B, 1991, 47, 891-899
9011278 CIFAu Te2C 1 2/m 17.189; 4.407; 5.069
90; 89.96; 90
160.596Reithmayer, K.; Steurer, W.; Schulz, H.; de Boer, J. L.
High-pressure single-crystal structure study on calaverite, AuTe2 Sample: P = 0.0001 GPa
Acta Crystallographica, Section B, 1993, 49, 6-11
9011279 CIFAu Te2C 1 2/m 17.189; 4.407; 5.069
90; 89.96; 90
160.596Reithmayer, K.; Steurer, W.; Schulz, H.; de Boer, J. L.
High-pressure single-crystal structure study on calaverite, AuTe2 Sample: P = <0.5 GPa
Acta Crystallographica, Section B, 1993, 49, 6-11
9011280 CIFAu Te2C 1 2/m 17.171; 4.385; 5.064
90; 90.04; 90
159.237Reithmayer, K.; Steurer, W.; Schulz, H.; de Boer, J. L.
High-pressure single-crystal structure study on calaverite, AuTe2 Sample: P = 0.41 GPa
Acta Crystallographica, Section B, 1993, 49, 6-11
9011281 CIFAu Te2C 1 2/m 17.164; 4.371; 5.064
90; 90; 90
158.573Reithmayer, K.; Steurer, W.; Schulz, H.; de Boer, J. L.
High-pressure single-crystal structure study on calaverite, AuTe2 Sample: P = 0.63 GPa
Acta Crystallographica, Section B, 1993, 49, 6-11
9011282 CIFAu Te2C 1 2/m 17.129; 4.314; 5.036
90; 90.15; 90
154.879Reithmayer, K.; Steurer, W.; Schulz, H.; de Boer, J. L.
High-pressure single-crystal structure study on calaverite, AuTe2 Sample: P = 1.63 GPa
Acta Crystallographica, Section B, 1993, 49, 6-11
9011283 CIFAu Te2C 1 2/m 17.11; 4.29; 5.05
90; 90.3; 90
154.032Reithmayer, K.; Steurer, W.; Schulz, H.; de Boer, J. L.
High-pressure single-crystal structure study on calaverite, AuTe2 Sample: P = 1.78 GPa
Acta Crystallographica, Section B, 1993, 49, 6-11
9011284 CIFAu Te2C 1 2/m 17.1; 4.286; 5.029
90; 90.3; 90
153.033Reithmayer, K.; Steurer, W.; Schulz, H.; de Boer, J. L.
High-pressure single-crystal structure study on calaverite, AuTe2 Sample: P = 1.89 GPa
Acta Crystallographica, Section B, 1993, 49, 6-11
9011285 CIFAu Te2C 1 2/m 17.1; 4.221; 5.029
90; 90.4; 90
150.711Reithmayer, K.; Steurer, W.; Schulz, H.; de Boer, J. L.
High-pressure single-crystal structure study on calaverite, AuTe2 Sample: P = 2.40 GPa
Acta Crystallographica, Section B, 1993, 49, 6-11
9011286 CIFAu Te2P -3 m 14.1; 4.1; 5.021
90; 90; 120
73.095Reithmayer, K.; Steurer, W.; Schulz, H.; de Boer, J. L.
High-pressure single-crystal structure study on calaverite, AuTe2 Sample: P = 3.72 GPa
Acta Crystallographica, Section B, 1993, 49, 6-11
9011287 CIFAu Te2P -3 m 14.078; 4.078; 5
90; 90; 120
72.01Reithmayer, K.; Steurer, W.; Schulz, H.; de Boer, J. L.
High-pressure single-crystal structure study on calaverite, AuTe2 Sample: P = 5.13 GPa
Acta Crystallographica, Section B, 1993, 49, 6-11
9011288 CIFH12 Ni O10 SP 43 21 26.7778; 6.7778; 18.176
90; 90; 90
834.979Ptasiewicz-Bak H; Olovsson, I.; McIntyre, G. J.
Bonding deformation and superposition in the electron density of tetragonal NiSO4*6H2O at 25K Sample: T = 25 K, neutron refinement Note: anisoU's from ICSD
Acta Crystallographica, Section B, 1993, 49, 192-201
9011289 CIFNi O10 SP 43 21 26.7778; 6.7778; 18.176
90; 90; 90
834.979Ptasiewicz-Bak H; Olovsson, I.; McIntyre, G. J.
Bonding deformation and superposition in the electron density of tetragonal NiSO4*6H2O at 25K Sample: T = 25 K, X-ray refinement
Acta Crystallographica, Section B, 1993, 49, 192-201
9011290 CIFF6 K2 SiF m -3 m8.1419; 8.1419; 8.1419
90; 90; 90
539.731Hester, J. R.; Maslen, E. N.; Spadaccini, N.; Ishizawa, N.; Satow, Y.
Accurate synchrotron radiation delta rho maps for K2SiF6 and K2PdCl6 Sample: .9 angstroms
Acta Crystallographica, Section B, 1993, 49, 967-973
9011291 CIFF6 K2 SiF m -3 m8.1419; 8.1419; 8.1419
90; 90; 90
539.731Hester, J. R.; Maslen, E. N.; Spadaccini, N.; Ishizawa, N.; Satow, Y.
Accurate synchrotron radiation delta rho maps for K2SiF6 and K2PdCl6 Sample: .7 angstroms
Acta Crystallographica, Section B, 1993, 49, 967-973
9011292 CIFF6 K2 SiF m -3 m8.1419; 8.1419; 8.1419
90; 90; 90
539.731Hester, J. R.; Maslen, E. N.; Spadaccini, N.; Ishizawa, N.; Satow, Y.
Accurate synchrotron radiation delta rho maps for K2SiF6 and K2PdCl6 Sample: Mo K-alpha
Acta Crystallographica, Section B, 1993, 49, 967-973
9011293 CIFCl6 K2 PdF m -3 m8.1419; 8.1419; 8.1419
90; 90; 90
539.731Hester, J. R.; Maslen, E. N.; Spadaccini, N.; Ishizawa, N.; Satow, Y.
Accurate synchrotron radiation delta rho maps for K2SiF6 and K2PdCl6
Acta Crystallographica, Section B, 1993, 49, 967-973
9011296 CIFFe4 H2 K2 Mg2 Na2 O15 Si4 TiP 110.37; 23.129; 5.322
90; 99.55; 90
1258.78Shi, N.; Ma, Z.; Li, G.; Yamnova, M. A.; Pushcharovsky, D. Y.
Structure refinement of monoclinic astrophyllite Locality: Khibina alkaline massif, Russia
Acta Crystallographica, Section B, 1998, 54, 109-114
9011298 CIFH34 O40 U8P b c n14.6861; 13.9799; 16.7063
90; 90; 90
3429.97Weller, M. T.; Light, M. E.; Gelbrich, T.
Structure of uranium (VI) oxide dihydrate UO3*2H2O; synthetic meta-schoepite (UO2)4O(OH)6*5H2O Sample: T = 150 K
Acta Crystallographica, Section B, 2000, 56, 577-583
9011299 CIFAl3 H21.52 N2.38 Na0.26 O20.64 Si5P 1 21/m 110.0507; 14.2016; 8.7281
90; 125.123; 90
1018.97Gualtieri, A. F.
Study of NH4+ in the zeolite phillipsite by combined synchrotron powder diffraction and IR spectroscopy Sample: 1
Acta Crystallographica, Section B, 2000, 56, 584-593
9011300 CIFAl2.2 H20.08 N2.02 Na0.2 O20.74 Si5.8P 1 21/m 110.0122; 14.1943; 8.7284
90; 125.024; 90
1015.82Gualtieri, A. F.
Study of NH4+ in the zeolite phillipsite by combined synchrotron powder diffraction and IR spectroscopy Sample: 2
Acta Crystallographica, Section B, 2000, 56, 584-593
9011301 CIFAl1.9 H18.8 N1.7 Na0.2 O21.18 Si6.1P 1 21/m 19.9596; 14.2015; 8.7051
90; 124.99; 90
1008.71Gualtieri, A. F.
Study of NH4+ in the zeolite phillipsite by combined synchrotron powder diffraction and IR spectroscopy Sample: 3
Acta Crystallographica, Section B, 2000, 56, 584-593
9011304 CIFC Na2 O3C 1 2/m 18.92; 5.245; 6.05
90; 101.35; 90
277.516Dusek, M.; Chapuis, G.; Meyer, M.; Petricek, V.
Sodium carbonate revisited Sample: Gamma phase, T = 295 K
Acta Crystallographica, Section B, 2003, 59, 337-352
9011305 CIFC Na2 O3C 1 2/m 18.898; 5.237; 5.996
90; 101.87; 90
273.432Dusek, M.; Chapuis, G.; Meyer, M.; Petricek, V.
Sodium carbonate revisited Sample: Delta phase, T = 110 K
Acta Crystallographica, Section B, 2003, 59, 337-352
9011308 CIFAg12.226 As1.192 Cu3.772 S11 Sb0.808P -3 m 17.389; 7.389; 11.816
90; 90; 120
558.692Bindi, L.; Evain, M.; Menchetti, S.
Temperature dependence of the silver distribution in the crystal structure of natural pearcite, (Ag,Cu)16(As,Sb)2S11 Sample: T = 15 K
Acta Crystallographica, Section B, 2006, 62, 212-219
9011309 CIFAg13.646 As1.179 Cu2.966 S11 Sb0.821P -3 m 17.3721; 7.3721; 11.8104
90; 90; 120
555.876Bindi, L.; Evain, M.; Menchetti, S.
Temperature dependence of the silver distribution in the crystal structure of natural pearcite, (Ag,Cu)16(As,Sb)2S11 Sample: T = 120 K
Acta Crystallographica, Section B, 2006, 62, 212-219
9011310 CIFAg13.032 As1.18 Cu2.968 S11 Sb0.82P -3 m 17.3876; 7.3876; 11.8882
90; 90; 120
561.893Bindi, L.; Evain, M.; Menchetti, S.
Temperature dependence of the silver distribution in the crystal structure of natural pearcite, (Ag,Cu)16(As,Sb)2S11 Sample: T = 300 K
Acta Crystallographica, Section B, 2006, 62, 212-219
9011311 CIFNa O3.5 Si1.5C 1 2/c 120.416; 6.4987; 4.9294
90; 90.26; 90
654.014Kruger, H.; Kahlenberg, V.; Friese, K.
Na2Si3O7: an incommensurate structure with crenel-type modulation functions, refined from a twinned crystal
Acta Crystallographica, Section B, 2006, 62, 440-446
9011312 CIFAg29.629 Cu2.371 S22 Sb4C 1 2/c 126.188; 15.1199; 23.784
90; 90; 90
9417.51Evain, M.; Bindi, L.; Menchetti, S.
Structural compexity in minerals: twinning, polytypism and disorder in the crystal structure of polybasite, (Ag,Cu)16(Sb,As)2S11 Sample: T = 100 K Sample: polytype 222
Acta Crystallographica, Section B, 2006, 62, 447-456
9011313 CIFAg29.04 Cu2.96 S22 Sb4P 3 2 115.0954; 15.0954; 11.8825
90; 90; 120
2344.92Evain, M.; Bindi, L.; Menchetti, S.
Structural compexity in minerals: twinning, polytypism and disorder in the crystal structure of polybasite, (Ag,Cu)16(Sb,As)2S11 Sample: T = 120 K Sample: polytype 221
Acta Crystallographica, Section B, 2006, 62, 447-456
9011314 CIFH2 Ni O2P -3 m 13.12; 3.12; 4.61
90; 90; 120
38.863Ramesh, T. N.; Kamath, P. V.; Shivakumara, C.
Classification of stacking faults and their stepwise elemination during the disorder -> order transformation of nickel hydroxide
Acta Crystallographica, Section B, 2006, 62, 530-536
9011315 CIFCa2 Co0.9 O7 Si2 Zn0.1P -423.518; 23.518; 5.0263
90; 90; 90
2780.03Jia, Z. H.; Schaper, A. K.; Massa, W.; Treutmann, W.; Rager, H.
Structure and phase transitions in Ca2CoSi2O7-Ca2ZnSi2O7 solid-solution crystals
Acta Crystallographica, Section B, 2006, 62, 547-555
9011317 CIF
Paper
Ag16.08 As0.34 Cu1.84 S8.34 Sb1.66 Se2.66P -3 m 17.595; 7.595; 12.0731
90; 90; 120
603.122Evain, M.; Bindi, L.; Menchetti, S.
Structure and phase transition of the Se-rich variety of antimonpearceite, [(Ag,Cu)~6~(Sb,As)~2~(S,Se)~7~][Ag~9~Cu(S,Se)~2~Se~2~]
Acta Crystallographica Section B, 2006, 62, 768-774
9011318 CIF
Paper
Ag14.691 Cu1.309 S8.37 Sb2 Se2.63P 1 21/c 113.1426; 7.5879; 23.729
90; 90; 90
2366.37Evain, M.; Bindi, L.; Menchetti, S.
Structure and phase transition of the Se-rich variety of antimonpearceite, [(Ag,Cu)~6~(Sb,As)~2~(S,Se)~7~][Ag~9~Cu(S,Se)~2~Se~2~]
Acta Crystallographica Section B, 2006, 62, 768-774
9011319 CIFCu0.298 Pb0.95 S3.36 Sb0.408 Sn0.851C -13.6661; 6.3138; 11.9028
92.49; 90.59; 89.986
275.24Evain, M.; Petricek, V.; Moelo, Y.; Maurel, C.
First (3+2)-dimensional superspace approach to the structure of levyclaudite-(Sb), a member of the cylindrite-type minerals
Acta Crystallographica, Section B, 2006, 62, 775-789
9011321 CIFCl2 Cu3 H6 Mg O6P -3 m 16.2733; 6.2733; 5.7472
90; 90; 120
195.875Malcherek, T.; Schluter, J.
Cu3MgCl2(OH)6 and the bond-valence parameters of the OH-Cl bond
Acta Crystallographica, Section B, 2007, 63, 157-160
9011322 CIFCl H6 Mg0.5 O2C m c m4.21616; 11.023; 7.2951
90; 90; 90
339.038Sugimoto, K.; Dinnebier, R. E.; Hanson, J. C.
Structures of three dehydration products of bischofite from in situ synchrotron powder diffraction data (MgCl2*nH2O; n = 1,2,4)
Acta Crystallographica, Section B, 2007, 63, 235-242
9011327 CIFK0.778 Mg0.388 O8 Ti3.612I 4/m10.1541; 10.1541; 2.9735
90; 90; 90
306.585Michiue, Y.
Probability density analyses of guest ions in hollandite AxMgx/2Ti8-x/2O16 (A = K, Rb) Sample: 1
Acta Crystallographica, Section B, 2007, 63, 577-583
9011328 CIFK0.774 Mg0.384 O8 Ti3.616I 4/m10.1541; 10.1541; 2.9735
90; 90; 90
306.585Michiue, Y.
Probability density analyses of guest ions in hollandite AxMgx/2Ti8-x/2O16 (A = K, Rb) Sample: 2
Acta Crystallographica, Section B, 2007, 63, 577-583
9011329 CIFK0.765 Mg0.383 O8 Ti3.617I 4/m10.1541; 10.1541; 2.9735
90; 90; 90
306.585Michiue, Y.
Probability density analyses of guest ions in hollandite AxMgx/2Ti8-x/2O16 (A = K, Rb) Sample: 3
Acta Crystallographica, Section B, 2007, 63, 577-583
9011330 CIFK0.77 Mg0.385 O8 Ti3.615I 4/m10.1541; 10.1541; 2.9735
90; 90; 90
306.585Michiue, Y.
Probability density analyses of guest ions in hollandite AxMgx/2Ti8-x/2O16 (A = K, Rb) Sample: 4
Acta Crystallographica, Section B, 2007, 63, 577-583
9011331 CIFMg0.377 O8 Rb0.754 Ti3.623I 4/m10.2052; 10.2052; 2.9717
90; 90; 90
309.491Michiue, Y.
Probability density analyses of guest ions in hollandite AxMgx/2Ti8-x/2O16 (A = K, Rb) Sample: 5
Acta Crystallographica, Section B, 2007, 63, 577-583
9011332 CIFMg0.377 O8 Rb0.754 Ti3.623I 4/m10.2052; 10.2052; 2.9717
90; 90; 90
309.491Michiue, Y.
Probability density analyses of guest ions in hollandite AxMgx/2Ti8-x/2O16 (A = K, Rb) Sample: 6
Acta Crystallographica, Section B, 2007, 63, 577-583
9011333 CIFMg0.375 O8 Rb0.751 Ti3.625I 4/m10.2052; 10.2052; 2.9717
90; 90; 90
309.491Michiue, Y.
Probability density analyses of guest ions in hollandite AxMgx/2Ti8-x/2O16 (A = K, Rb) Sample: 7
Acta Crystallographica, Section B, 2007, 63, 577-583
9011334 CIFMg0.376 O8 Rb0.751 Ti3.624I 4/m10.2052; 10.2052; 2.9717
90; 90; 90
309.491Michiue, Y.
Probability density analyses of guest ions in hollandite AxMgx/2Ti8-x/2O16 (A = K, Rb) Sample: 8
Acta Crystallographica, Section B, 2007, 63, 577-583
9011335 CIFMg0.378 O8 Rb0.756 Ti3.622I 4/m10.2052; 10.2052; 2.9717
90; 90; 90
309.491Michiue, Y.
Probability density analyses of guest ions in hollandite AxMgx/2Ti8-x/2O16 (A = K, Rb) Sample: 9
Acta Crystallographica, Section B, 2007, 63, 577-583
9011338 CIFAl7 Ca6 O16.348I -4 3 d12.0449; 12.0449; 12.0449
90; 90; 90
1747.47Boysen, H.; Lerch, M.; Stys, A.; Senyshyn, A.
Structure and oxygen mobility in mayenite (Ca12Al14O33): a high-temperature neutron powder diffraction study Sample: T = 1223 K
Acta Crystallographica, Section B, 2007, 63, 675-682
9011379 CIFCl5 Fe H2 K2 OP n m a13.452; 9.631; 7.003
90; 90; 90
907.282Schultz, A. J.; Carlin, R. L.
Single-crystal pulsed neutron diffraction structure of the antiferromagnet K2[FeCl5(H2O)] with and without applied pressure Sample: P = .1 MPa Sample: T = 15 K
Acta Crystallographica, Section B, 1995, 51, 43-47
9011380 CIFCl5 Fe H2 K2 OP n m a13.391; 9.648; 6.942
90; 90; 90
896.881Schultz, A. J.; Carlin, R. L.
Single-crystal pulsed neutron diffraction structure of the antiferromagnet K2[FeCl5(H2O)] with and without applied pressure Sample: P = .14 GPa Sample: T = 15 K
Acta Crystallographica, Section B, 1995, 51, 43-47
9013161 CIFFe4 H4 K2 Mg2 Na2 O30 Si8 Ti2A 1 2 110.37; 23.129; 5.322
90; 99.55; 90
1258.78Shi, N.; Ma, Z.; Li, G.; Yamnova, M. A.; Pushcharovsky, D. Y.
Structure Refinement of Monoclinic Astrophyllite
Acta Crystallographica Section B, 1998, 54, 109-114

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