Crystallography Open Database
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COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 9007531 | CIF | O2 Ti | P 42/m n m | 4.5941; 4.5941; 2.9589 90; 90; 90 | 62.45 | Baur, 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 | CIF | Ge O2 | P 42/m n m | 4.3975; 4.3975; 2.8625 90; 90; 90 | 55.355 | Baur, 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 | CIF | O2 Sn | P 42/m n m | 4.738; 4.738; 3.1865 90; 90; 90 | 71.533 | Baur, 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 | CIF | F2 Mg | P 42/m n m | 4.6213; 4.6213; 3.0159 90; 90; 90 | 64.409 | Baur, 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 | CIF | F2 Mn | P 42/m n m | 4.8738; 4.8738; 3.3107 90; 90; 90 | 78.642 | Baur, 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 | CIF | F2 Fe | P 42/m n m | 4.6945; 4.6945; 3.3097 90; 90; 90 | 72.94 | Baur, 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 | CIF | Co F2 | P 42/m n m | 4.6954; 4.6954; 3.1774 90; 90; 90 | 70.051 | Baur, 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 | CIF | F2 Ni | P 42/m n m | 4.6498; 4.6498; 3.0838 90; 90; 90 | 66.674 | Baur, 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 | CIF | F2 Zn | P 42/m n m | 4.7048; 4.7048; 3.1338 90; 90; 90 | 69.367 | Baur, 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 | CIF | Cr O2 | P 42/m n m | 4.421; 4.421; 2.917 90; 90; 90 | 57.013 | Baur, 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 | CIF | O2 Ru | P 42/m n m | 4.4919; 4.4919; 3.1066 90; 90; 90 | 62.682 | Baur, 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 | CIF | O2 Os | P 42/m n m | 4.5003; 4.5003; 3.1839 90; 90; 90 | 64.483 | Baur, 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 | CIF | O2 Pb | P 42/m n m | 4.9568; 4.9568; 3.3866 90; 90; 90 | 83.208 | Baur, 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 | CIF | As3 Co0.87 Fe0.11 Ni0.13 | I m -3 | 8.195; 8.195; 8.195 90; 90; 90 | 550.36 | Mandel, N.; Donohue, J. The refinement of the crystal structure of skutterudite, CoAs3 Acta Crystallographica, Section B, 1971, 27, 2288-2289 |
| 9007545 | CIF | As Ca H3 O5 | P c n b | 6.904; 16.161; 7.935 90; 90; 90 | 885.352 | Ferraris, 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 | CIF | As Ca H2 O5 | P c n b | 6.904; 16.161; 7.935 90; 90; 90 | 885.352 | Ferraris, 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 | CIF | Cr H4 N Na O6 | P 21 21 21 | 8.413; 13.039; 6.219 90; 90; 90 | 682.206 | Khan, 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 | CIF | H10 Mg N2 O12 P2 | P b c a | 11.49; 23.66; 8.62 90; 90; 90 | 2343.38 | Khan, 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 | CIF | C H6 Mg O6 | P 1 21/n 1 | 7.7053; 5.3673; 12.1212 90; 90.451; 90 | 501.277 | Stephan, G. W.; MacGillavry, C. H. The crystal structure of nesquehonite, MgCO3*3H2O Acta Crystallographica, Section B, 1972, 28, 1031-1033 |
| 9007550 | CIF | Ca Cu4 H12 O17 S2 | P 1 21/c 1 | 20.87; 6.135; 22.191 90; 102.73; 90 | 2771.44 | Sabelli, 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 | CIF | Ni5.629 S4.86 | B m m b | 3.274; 16.157; 11.359 90; 90; 90 | 600.869 | Fleet, M. E. The crystal structure of alpha-Ni7S6 Acta Crystallographica, Section B, 1972, 28, 1237-1241 |
| 9007552 | CIF | H10 Mg O9 S | P -1 | 6.314; 10.505; 6.03 81.12; 109.82; 105.08 | 362.347 | Baur, 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 | CIF | F Mn2 O4 P | C 1 2/c 1 | 13.41; 6.5096; 10.094 90; 119.99; 90 | 763.169 | Rea, J. R.; Kostiner, E. The crystal structure of manganese fluorophosphate, Mn2(PO4)F Acta Crystallographica, Section B, 1972, 28, 2525-2529 |
| 9007554 | CIF | N Na O3 | R -3 c :H | 5.07; 5.07; 16.82 90; 90; 120 | 374.432 | Paul, 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 | CIF | N Na O3 | R -3 c :H | 5.074; 5.074; 16.97 90; 90; 120 | 378.367 | Paul, 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 | CIF | N Na O3 | R -3 c :H | 5.077; 5.077; 17.13 90; 90; 120 | 382.386 | Paul, 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 | CIF | N Na O3 | R -3 c :H | 5.079; 5.079; 17.23 90; 90; 120 | 384.922 | Paul, 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 | CIF | N Na O3 | R -3 c :H | 5.081; 5.081; 17.27 90; 90; 120 | 386.119 | Paul, 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 | CIF | N Na O3 | R -3 c :H | 5.082; 5.082; 17.31 90; 90; 120 | 387.166 | Paul, 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 | CIF | N Na O3 | R -3 m :H | 5.084; 5.084; 8.175 90; 90; 120 | 182.991 | Paul, 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 | CIF | N Na O3 | R -3 c :H | 5.07; 5.07; 16.82 90; 90; 120 | 374.432 | Paul, 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 | CIF | N Na O3 | R -3 c :H | 5.074; 5.074; 16.97 90; 90; 120 | 378.367 | Paul, 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 | CIF | N Na O3 | R -3 c :H | 5.077; 5.077; 17.13 90; 90; 120 | 382.386 | Paul, 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 | CIF | N Na O3 | R -3 c :H | 5.079; 5.079; 17.23 90; 90; 120 | 384.922 | Paul, 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 | CIF | N Na O3 | R -3 c :H | 5.081; 5.081; 17.27 90; 90; 120 | 386.119 | Paul, 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 | CIF | N Na O3 | R -3 c :H | 5.082; 5.082; 17.31 90; 90; 120 | 387.166 | Paul, 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 | CIF | N Na O3 | R -3 m :H | 5.084; 5.084; 8.175 90; 90; 120 | 182.991 | Paul, 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 | CIF | Al0.7 Ca12.098 F8.4 H13 Mg0.1 Na0.102 O35.6 Si10 | R -3 :H | 9.36; 9.36; 36.48 90; 90; 120 | 2767.82 | Merlino, S. The crystal structure of zeophyllite Acta Crystallographica, Section B, 1972, 28, 2726-2732 |
| 9007569 | CIF | K2 O4 S | P n a m | 7.476; 10.071; 5.763 90; 90; 90 | 433.901 | McGinnety, 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 | CIF | Cr K2 O4 | P n a m | 7.663; 10.388; 5.922 90; 90; 90 | 471.41 | McGinnety, 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 | CIF | As H15 Mg O11 | C 1 2/c 1 | 6.6918; 25.744; 11.538 90; 95.15; 90 | 1979.67 | Ferraris, 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 | CIF | Cu Fe S2 | I -4 2 d | 5.289; 5.289; 10.423 90; 90; 90 | 291.568 | Hall, S. R.; Stewart, J. M. The crystal structure refinement of chalcopyrite, CuFeS2 Acta Crystallographica, Section B, 1973, 29, 579-585 |
| 9007573 | CIF | As H16 Mg N O10 | P m n 21 | 7.054; 6.205; 11.368 90; 90; 90 | 497.578 | Ferraris, 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 | CIF | Ni0.5 Pd Pt2.5 S4 | P 42/m | 6.38; 6.38; 6.57 90; 90; 90 | 267.428 | Childs, J. D.; Hall, S. R. The crystal structure of braggite, (Pt,Pd,Ni)S Acta Crystallographica, Section B, 1973, 29, 1446-1451 |
| 9007575 | CIF | C H6 Cu2 O21 Pb5 S3 | P m n 21 | 20.089; 7.146; 6.56 90; 90; 90 | 941.727 | Giacovazzo, C.; Menchetti, S.; Scordari, F. The crystal structure of caledonite, Cu2Pb5(SO4)3CO3(OH)6 Acta Crystallographica, Section B, 1973, 29, 1986-1990 |
| 9007576 | CIF | Ba6 Cl4.6 Fe0.15 H0.5 Mn2.082 O19 Si6 Ti0.768 | P 6/m m m | 16.398; 16.398; 7.2 90; 90; 120 | 1676.66 | Kampf, 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 | CIF | Al H4 O6 P | P 1 21/n 1 | 5.178; 9.514; 8.454 90; 90.35; 90 | 416.466 | Kniep, R.; Mootz, D. Metavariscite - A redetermination of its crystal structure Acta Crystallographica, Section B, 1973, 29, 2292-2294 |
| 9007578 | CIF | Bi Cu3 S3 | P 21 21 21 | 7.723; 10.395; 6.716 90; 90; 90 | 539.164 | Kocman, V.; Nuffield, E. W. The crystal structure of wittichenite, Cu3BiS3 Acta Crystallographica, Section B, 1973, 29, 2528-2535 |
| 9007579 | CIF | As S3 Sb | P 1 21/a 1 | 11.8568; 9.0152; 10.1938 90; 116.365; 90 | 976.29 | Guillermo, T. R.; Wuensch, B. J. The crystal structure of getchellite, AsSbS3 Acta Crystallographica, Section B, 1973, 29, 2536-2541 |
| 9007580 | CIF | H6 N O4 P | I -4 2 d | 7.4997; 7.4997; 7.5494 90; 90; 90 | 424.62 | Khan, 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 | CIF | As H6 N O4 | I -4 2 d | 7.6998; 7.6998; 7.7158 90; 90; 90 | 457.446 | Khan, 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 | CIF | H2 K O4 P | P 21 21 21 | 7.434; 7.434; 6.945 90; 90; 90 | 383.811 | Baur, 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 | CIF | H6 N O4 P | P 21 21 21 | 7.4997; 7.4997; 7.5493 90; 90; 90 | 424.614 | Baur, 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 | CIF | H12 O16 S2 V2 | P 1 21/c 1 | 7.411; 7.439; 12.272 90; 108.9; 90 | 640.084 | Theobald, F.; Galy, J. Structure cristalline de VOSO4((H2O)3 Locality: synthetic Note: polymorph of bobjonesite Acta Crystallographica, Section B, 1973, 29, 2732-2736 |
| 9007585 | CIF | Cu2 O7 V2 | F d d 2 | 20.68; 8.411; 6.448 90; 90; 90 | 1121.56 | Mercurio-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 | CIF | As2 Fe H5 O10 Pb Zn | C 1 2/m 1 | 9.124; 6.329; 7.577 90; 115.28; 90 | 395.637 | Tillmanns, 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 | CIF | O3 Sb2 | P c c n | 4.911; 12.464; 5.412 90; 90; 90 | 331.272 | Svensson, C. The crystal structure of orthorhombic antimony trioxide, Sb2O3 Acta Crystallographica, Section B, 1974, 30, 458-461 |
| 9007588 | CIF | Cu3 H4 I6 O20 | P -1 | 7.256; 7.9503; 7.8559 105.096; 92.945; 96.952 | 432.702 | Ghose, 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 | CIF | Al9 Ba3.5 Ca5.5 H2 K0.5 Na0.5 O55 S3 Si11 | P -6 2 m | 13.511; 13.511; 7.462 90; 90; 120 | 1179.67 | Merlino, S. The crystal structure of wenkite Acta Crystallographica, Section B, 1974, 30, 1262-1266 |
| 9007590 | CIF | Sb2 Te3 | R -3 m :H | 4.264; 4.264; 30.458 90; 90; 120 | 479.586 | Anderson, 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 | CIF | Sb2 Se Te2 | R -3 m :H | 4.188; 4.188; 29.937 90; 90; 120 | 454.729 | Anderson, 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 | CIF | Al3 H4 Na O12 P2 | P 1 21/n 1 | 11.233; 10.142; 7.097 90; 97.37; 90 | 801.847 | Gatehouse, B. M.; Miskin, B. K. The crystal structure of brazilianite, NaAl3(PO4)2(OH)4 Acta Crystallographica, Section B, 1974, 30, 1311-1317 |
| 9007593 | CIF | S8 | P 1 2/c 1 | 8.442; 13.025; 9.356 90; 124.98; 90 | 842.915 | Watanabe, Y. The crystal structure of monoclinic gamma-sulfur Acta Crystallographica, Section B, 1974, 30, 1396-1401 |
| 9007594 | CIF | As5 Ca6.25 H20 O30 | P 1 21/n 1 | 17.63; 6.734; 23.47 90; 90.6; 90 | 2786.22 | Catti, M.; Ferraris, G. Crystal structure of Ca5(HAsO4)2(AsO4)2*9H2O (guerinite) Acta Crystallographica, Section B, 1974, 30, 1789-1794 |
| 9007595 | CIF | O4 Sn W | P n n a | 5.627; 11.6486; 4.9973 90; 90; 90 | 327.556 | Jeitschko, 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 | CIF | B3 H15 Mg O13 | P -1 | 8.3479; 10.6068; 6.4447 98.846; 108.981; 105.581 | 501.239 | Corazza, E. The crystal structure of kurnakovite: a refinement Acta Crystallographica, Section B, 1974, 30, 2194-2199 |
| 9007597 | CIF | F H28 Na7 O27 P2 | F d -3 c :2 | 27.755; 27.755; 27.755 90; 90; 90 | 21380.8 | Baur, 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 | CIF | As2 F H28 Na7 O27 | F d -3 c :2 | 28.12; 28.12; 28.12 90; 90; 90 | 22235.5 | Baur, 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 | CIF | Mg2 O7 V2 | P -1 | 13.767; 5.414; 4.912 81.42; 106.82; 130.33 | 266.795 | Gopal, 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 | CIF | Co2 O7 V2 | P 1 21/c 1 | 6.594; 8.38; 9.47 90; 100.17; 90 | 515.069 | Sauerbrei, E. E.; Faggiani, R.; Calvo, C. Cobalt vanadate, Co2V2O7, and nickel vanadate, Ni2V2O7 Acta Crystallographica, Section B, 1974, 30, 2907-2909 |
| 9007601 | CIF | Ni2 O7 V2 | P 1 21/c 1 | 6.515; 8.303; 9.35 90; 99.86; 90 | 498.309 | Sauerbrei, 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 | CIF | Cl Cu2 H3 O3 | R -3 :H | 13.654; 13.654; 14.041 90; 90; 120 | 2266.98 | Fleet, 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 | CIF | Cl Cu2 H3 O3 | R -3 :H | 6.827; 6.827; 14.041 90; 90; 120 | 566.746 | Fleet, 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 | CIF | Cl Cu2 O3 | R -3 :H | 6.827; 6.827; 14.041 90; 90; 120 | 566.746 | Fleet, M. E. The crystal structure of paratacamite, Cu2(OH)3Cl Sample: Substructure, with disordered oxygens Acta Crystallographica, Section B, 1975, 31, 183-187 |
| 9007605 | CIF | As Fe H4 O6 | P b c a | 10.325; 8.953; 10.038 90; 90; 90 | 927.91 | Kitahama, K.; Kiriyama, R.; Yoshihisa, B. Refinement of the crystal structure of scorodite Acta Crystallographica, Section B, 1975, 31, 322-324 |
| 9007606 | CIF | Cu2 O7 V2 | F d d 2 | 20.645; 8.383; 6.442 90; 90; 90 | 1114.9 | Calvo, C.; Faggiani, R. Alpha cupric divanadate Acta Crystallographica, Section B, 1975, 31, 603-605 |
| 9007607 | CIF | B2 Ca3 O6 | R -3 c :H | 8.6377; 8.6377; 11.849 90; 90; 120 | 765.612 | Vegas, A.; Cano, F. H.; Garcia-Blanco S The crystal structure of calcium orthoborate: a redetermination Acta Crystallographica, Section B, 1975, 31, 1416-1419 |
| 9007608 | CIF | Cu H4 Na2 O10 S2 | P 1 21/c 1 | 5.807; 12.656; 5.517 90; 108.32; 90 | 384.912 | Hawthorne, F. C.; Ferguson, R. B. Refinement of the crystal structure of krohnkite Acta Crystallographica, Section B, 1975, 31, 1753-1755 |
| 9007609 | CIF | O3 Sb2 | F d -3 m :1 | 11.1519; 11.1519; 11.1519 90; 90; 90 | 1386.91 | Svensson, C. Refinement of the crystal structure of cubic antiomony trioxide, Sb2O3 Acta Crystallographica, Section B, 1975, 31, 2016-2018 |
| 9007610 | CIF | Li0.55 Mn4 Na0.45 O15 Si5 | P -1 | 7.621; 11.761; 6.731 92.767; 95.083; 106.867 | 573.345 | Narita, 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 | CIF | Ca3 H6 O10 Si2 | C 1 c 1 | 16.278; 5.6321; 13.236 90; 134.898; 90 | 859.577 | Malik, K. M. A.; Jeffery, J. W. A re-investigation of the structure of afwillite Acta Crystallographica, Section B, 1976, 32, 475-480 |
| 9007612 | CIF | B3 H15 Mg O13 | P 1 21/c 1 | 6.8221; 13.1145; 12.035 90; 104.552; 90 | 1042.21 | Corazza, E. Inderite: Crystal structure refinement and relationship to kurnakovite Acta Crystallographica, Section B, 1976, 32, 1329-1333 |
| 9007613 | CIF | As H9 Mg O8 | P b c a | 7.472; 10.891; 16.585 90; 90; 90 | 1349.65 | Protas, 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 | CIF | As3 Ca2 Mg1.7 Mn0.3 Na O12 | I a -3 d | 12.355; 12.355; 12.355 90; 90; 90 | 1885.94 | Hawthorne, F. C. Refinement of the crystal structure of berzeliite Note: garnet structure Acta Crystallographica, Section B, 1976, 32, 1581-1583 |
| 9007615 | CIF | Bi5 Cu Pb S9 | P b n m | 33.531; 11.486; 4.003 90; 90; 90 | 1541.7 | Kohatsu, 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 | CIF | Ca0.017 Fe0.614 Li0.301 Mg0.036 Mn0.333 Na0.014 O4 P0.965 | P m n b | 5.918; 10.037; 4.798 90; 90; 90 | 284.996 | Alberti, A. Crystal structure of ferrisicklerite, Li<1(Fe3+,Mn2+)PO4 Acta Crystallographica, Section B, 1976, 32, 2761-2764 |
| 9007617 | CIF | O4 Pb W | P 1 21/a 1 | 13.555; 4.976; 5.561 90; 107.63; 90 | 357.471 | Fujita, T.; Kawada, I.; Kato, K. Raspite from Broken Hill Acta Crystallographica, Section B, 1977, 33, 162-164 |
| 9007618 | CIF | Al H4 O6 P | P b c a | 9.822; 8.561; 9.63 90; 90; 90 | 809.75 | Kniep, R.; Mootz, D.; Vegas, A. Variscite Acta Crystallographica, Section B, 1977, 33, 263-265 |
| 9007619 | CIF | Ca4 H4 O16 P4 | P -1 | 6.91; 6.627; 6.998 96.34; 103.82; 88.33 | 309.275 | Catti, 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 | CIF | C4 H10 Mg5 O18 | P 1 21/c 1 | 10.105; 8.954; 8.378 90; 114.44; 90 | 690.118 | Akao, M.; Iwai, S. The hydrogen bonding of hydromagnesite Acta Crystallographica, Section B, 1977, 33, 1273-1275 |
| 9007621 | CIF | As2 Ca Fe O7 Sb | I 41/a :2 | 16.144; 16.144; 10.706 90; 90; 90 | 2790.29 | Coda, A.; Dal Negro, A.; Sabelli, C.; Tazzoli, V. The crystal structure of stenhuggarite Acta Crystallographica, Section B, 1977, 33, 1807-1811 |
| 9007622 | CIF | Al2 Ba0.24 H10 K0.01 O21 Si6 Sr0.71 | P 1 21/m 1 | 6.793; 17.573; 7.759 90; 94.54; 90 | 923.312 | Schlenker, 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 | CIF | C0.5 H4 Mg O4 | C 1 2/m 1 | 16.56; 3.153; 6.231 90; 99.1; 90 | 321.249 | Akao, M.; Iwai, S. The hydrogen bonding of artinite Note: anisotropic displacement parameters obtained from ICSD Acta Crystallographica, Section B, 1977, 33, 3951-3953 |
| 9007624 | CIF | O4 Si Th | I 41/a m d :2 | 7.1328; 7.1328; 6.3188 90; 90; 90 | 321.481 | Taylor, M.; Ewing, R. C. The crystal structure of the ThSiO4 polymorphs: huttonite and thorite Acta Crystallographica, Section B, 1978, 34, 1074-1079 |
| 9007625 | CIF | O4 Si Th | P 1 21/n 1 | 6.784; 6.974; 6.5 90; 104.92; 90 | 297.158 | Taylor, M.; Ewing, R. C. The crystal structure of the ThSiO4 polymorphs: huttonite and thorite Acta Crystallographica, Section B, 1978, 34, 1074-1079 |
| 9007626 | CIF | Al2 H18 O15 S | P 1 21/c 1 | 7.44; 15.583; 11.7 90; 110.18; 90 | 1273.2 | Sabelli, C.; Ferroni, R. T. The crystal structure of aluminite Note: anisotropic displacement factors from ICSD Acta Crystallographica, Section B, 1978, 34, 2407-2412 |
| 9007627 | CIF | O4 Si Zn2 | R -3 :H | 13.948; 13.948; 9.315 90; 90; 120 | 1569.41 | Klaska, 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 | CIF | As2 Cu3 H2 O10 Pb | C 1 2/c 1 | 10.147; 5.892; 14.081 90; 106.05; 90 | 809.034 | Ghose, 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 | CIF | As H Mn4 O13 Si3 | P 1 21/n 1 | 6.66; 19.92; 7.67 90; 95.7; 90 | 1012.53 | Gramaccioli, 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 | CIF | Ba5 Cl O12 P3 | P 63/m | 10.284; 10.284; 7.651 90; 90; 120 | 700.766 | Hata, M.; Marumo, F.; Iwai, S.; Aoki, H. Structure of barium chlorapatite Acta Crystallographica, Section B, 1979, 35, 2382-2384 |
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