Crystallography Open Database

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2300034 CIFFe2 O7 P2C -16.643; 8.447; 4.495
90.43; 103.8; 92.49
244.7Henry, Paul F.; Weller, Mark T.; Wilson, Chick C.
Determination of the cation distribution in Fe~2~Ni(PO~4~)~2~ using isotopic substitution and powder neutron diffraction
Journal of Applied Crystallography, 2003, 36, 1361-1367
2310531 CIFAl K O8 Si3C -18.56; 12.964; 7.215
90.65; 115.83; 87.7
720.071Brown, B.E.; Bailey, Y.W.
The structure of maximum microcline
Acta Crystallographica (1,1948-23,1967), 1964, 17, 1391-1400
2310574 CIFAl Na O8 Si3C -18.149; 12.88; 7.106
93.37; 116.3; 90.28
667.08Ferguson, R.B.; Traill, R.J.; Taylor, W.H.
The crystal structures of low-temperature and high-temperature albites
Acta Crystallographica (1,1948-23,1967), 1958, 11, 331-348
4030922 CIFFe O11 P4C -112.964; 13.139; 10.693
89.46; 117.03; 90.23
1622.4Weil, M.; Glaum, R.
Crystallization of ultraphosphates via the gas phase. The crystal structures of FeP~4~O~11~, ZnP~4~O~11~ and CdP~4~O~11~
European Journal of Solid State and Inorganic Chemistry, 1998, 35, 495-508
4030923 CIFO11 P4 ZnC -112.882; 13.049; 10.609
89.36; 117.19; 90.36
1586.2Weil, M.; Glaum, R.
Crystallization of ultraphosphates via the gas phase. The crystal structures of FeP~4~O~11~, ZnP~4~O~11~ and CdP~4~O~11~
European Journal of Solid State and Inorganic Chemistry, 1998, 35, 495-508
4030924 CIFCd O11 P4C -113.311; 13.334; 10.865
89.96; 117.12; 90.14
1716.4Weil, M.; Glaum, R.
Crystallization of ultraphosphates via the gas phase. The crystal structures of FeP~4~O~11~, ZnP~4~O~11~ and CdP~4~O~11~
European Journal of Solid State and Inorganic Chemistry, 1998, 35, 495-508
4113278 CIFSb10 Zn13C -132.536; 12.237; 10.852
90; 98.77; 90
4270.1Johanna Nylén; Magnus Andersson; Sven Lidin; Ulrich Häussermann
The Structure of α-Zn4Sb3: Ordering of the Phonon-Glass Thermoelectric Material β-Zn4Sb3
Journal of the American Chemical Society, 2004, 126, 16306-16307
4123989 CIFC9 Co3 O9 SeC -19.503; 13.9184; 14.1229
114.317; 117.752; 84.556
1495.55Strouse, C.E.; Dahl, L.F.
XXII. Syntheses and structural analyses by X-ray diffraction and electron spin resonance single-crystal methods of Co3 (C O)9 Se, Fe Co2 (C O)9 Se and Fe Co2 (C O)9 Te. The antibonding metallic nature of an unpaired electron in ...
Journal of the American Chemical Society, 1971, 93, 6032-6041
4123990 CIFC9 Co2 Fe O9 SeC -19.4595; 13.8419; 14.0908
114.005; 117.66; 84.608
1482.52Strouse, C.E.; Dahl, L.F.
XXII. Syntheses and structural analyses by x-ray diffraction and electron spin resonance single-crystal methods of Co3 (C O)9 Se, Fe Co2 (C O)9 Se and Fe Co2 (C O)9 Te. The antibonding metallic nature of an unpaired electron in ...
Journal of the American Chemical Society, 1971, 93, 6032-6041
4123991 CIFC9 Co2 Fe O9 TeC -18.773; 15.205; 14.578
117.29; 118.73; 78.42
1514.94Strouse, C.E.; Dahl, L.F.
XXII. Syntheses and structural analyses by x-ray diffraction and electron spin resonance single-crystal methods of Co3 (C O)9 Se, Fe Co2 (C O)9 Se and Fe Co2 (C O)9 Te. The antibonding metallic nature of an unpaired electron in ...
Journal of the American Chemical Society, 1971, 93, 6032-6041
4315313 CIFC204 H80 Cl4 Mn N10C -128.5037; 15.3623; 30.1121
90.173; 109.828; 89.514
12403.4Dmitri V. Konarev; Salavat S. Khasanov; Guzeliya R. Mukhamadieva; Leokadia V. Zorina; Akihiro Otsuka; Hideki Yamochi; Gunzi Saito; Rimma N. Lyubovskaya
Magnetic and Structural Transitions at Dimerization of C60. -in Ionic Fullerene Complexes with Metalloporphyrins: {(TMP+)2.MIITPP}.(C60-)2.(C6H4Cl2)2.(C6H5CN)2 (M = Zn and Mn)
Inorganic Chemistry, 2010, 49, 3881-3887
4325056 CIFC11 H14 Cl N O2C -113.5893; 13.6734; 25.0498
89.985; 99.204; 89.986
4594.6Ross S. Forgan; Benjamin D. Roach; Peter A. Wood; Fraser J. White; John Campbell; David K. Henderson; Eduardo Kamenetzky; Fiona E. McAllister; Simon Parsons; Elna Pidcock; Patricia Richardson; Ronald M. Swart; Peter A. Tasker
Using the Outer Coordination Sphere to Tune the Strength of Metal Extractants
Inorganic Chemistry, 2011, 50, 4515-4522
4325057 CIFC11 H14 Br N O2C -113.8459; 13.9486; 24.8103
90; 99.796; 90
4721.8Ross S. Forgan; Benjamin D. Roach; Peter A. Wood; Fraser J. White; John Campbell; David K. Henderson; Eduardo Kamenetzky; Fiona E. McAllister; Simon Parsons; Elna Pidcock; Patricia Richardson; Ronald M. Swart; Peter A. Tasker
Using the Outer Coordination Sphere to Tune the Strength of Metal Extractants
Inorganic Chemistry, 2011, 50, 4515-4522
4346001 CIFC87 H134 F30 N24 O35 Ru4 S10C -139.586; 9.3248; 24.118
90; 121.958; 90
7553Louise A. Berben; Mary C. Faia; Nathan R. M. Crawford; Jeffrey R. Long
Angle-Dependent Electronic Effects in 4,4'-Bipyridine-Bridged Ru3 Triangle and Ru4 Square Complexes
Inorganic Chemistry, 2006, 45, 6378-6386
4505241 CIFC10 H24 Mn N2 O13C -114.544; 28.47; 10.646
89.78; 126.43; 89.98
3547Hao, Xiang; Siegler, Maxime A.; Parkin, Sean; Brock, Carolyn Pratt
[M(H2O)2(15-crown-5)](NO3)2: A System Rich in Polymorphic and Modulated Phases†
Crystal Growth & Design, 2005, 5, 2225
4505242 CIFC10 H24 Mn N2 O13C -114.73; 28.329; 10.786
89.95; 126.05; 90.05
3639Hao, Xiang; Siegler, Maxime A.; Parkin, Sean; Brock, Carolyn Pratt
[M(H2O)2(15-crown-5)](NO3)2: A System Rich in Polymorphic and Modulated Phases†
Crystal Growth & Design, 2005, 5, 2225
7103506 CIFC22 H16 Fe N8 S2C -115.7337; 10.5731; 14.1664
93.971; 116.104; 90.375
2109.37Bonnet, Sylvestre; Siegler, Maxime A; Costa, José Sánchez; Molnár, Gábor; Bousseksou, Azzedine; Spek, Anthony L; Gamez, Patrick; Reedijk, Jan
A two-step spin crossover mononuclear iron(II) complex with a [HS-LS-LS] intermediate phase.
Chemical communications (Cambridge, England), 2008, 5619-5621
7206608 CIFC24 H22 Co N4 O12 V4C -115.4955; 12.1132; 7.9099
88.155; 95.227; 90.875
1477.63Fernández de Luis, Roberto; Urtiaga, M. Karmele; Mesa, José L.; Segura, Joseba Orive Gómez de; Rojo, Teófilo; Arriortua, María I.
{Co(HBpe)2}(V4O12): pedal motion induced order‒disorder P1̄\ρightarrow C1̄ transition and disrupted C1̄→C2/m displacive transition due to thermal instability
CrystEngComm, 2011, 13, 6488
7206609 CIFC24 H22 Co N4 O12 V4C -115.456; 12.141; 7.915
89.727; 95.358; 90.177
1478.7Fernández de Luis, Roberto; Urtiaga, M. Karmele; Mesa, José L.; Segura, Joseba Orive Gómez de; Rojo, Teófilo; Arriortua, María I.
{Co(HBpe)2}(V4O12): pedal motion induced order‒disorder P1̄\ρightarrow C1̄ transition and disrupted C1̄→C2/m displacive transition due to thermal instability
CrystEngComm, 2011, 13, 6488
8103542 CIFAl K0.58 Na0.42 O8 Si3C -18.434; 13.015; 7.1717
90; 116.09; 90
707.012Fenn, P.M.; Brown, G.E.
Crystal structure of a synthetic, compositionally intermediate, hypersolvus alkali felspar: evidence for Na, K site ordering
Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (145,1977-148,1979), 1977, 145, 124-145
8103560 CIFAl1.46 Ca0.347 Na0.685 O8 Si2.54C -18.178; 12.865; 7.109
93.53; 116.21; 89.92
669.485Horst, W.; Tagai, T.; Korekawa, M.; Jagodzinski, H.
Modulated structure of a plagioclase An52: Theory and structure determination
Zeitschrift fuer Kristallographie (149,1979-), 1981, 157, 233-250
8103645 CIFCa Ge2 O5C -16.53; 8.8; 7.4
90.75; 121.25; 91.05
363.349Aust, H.; Voellenkle, H.; Wittmann, A.
Die Kristallstruktur der Hoch- und der Tieftemperaturform von Ca Ge2 O5
Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977), 1976, 144, 82-90
9000115 CIFAl1.2 Cr0.7 H8 Mg5.1 O18 Si3C -15.338; 9.247; 14.435
90; 97.08; 90
707.086Brown, B. E.; Bailey, S. W.
Chlorite polytypism: II. Crystal structure of a one-layer Cr-chlorite Note: variety called kammererite
American Mineralogist, 1963, 48, 42-61
9000135 CIFB Na O8 Si3C -17.833; 12.36; 6.803
93.308; 116.352; 92.055
587.819Appleman, D. E.; Clark, J. R.
Crystal structure of reedmergnerite, a boron albite, and its relation to feldspar crystal chemistry
American Mineralogist, 1965, 50, 1827-1850
9000189 CIFAl0.93 K O8 Si3.07C -18.5784; 12.96; 7.2112
90.3; 116.03; 89.125
720.306Bailey, S. W.
Refinement of an intermediate microcline structure
American Mineralogist, 1969, 54, 1540-1545
9000276 CIFAl H O6 Si2C -15.1614; 8.9576; 9.3511
91.03; 100.37; 89.75
425.206Wardle, R.; Brindley, G. W.
The crystal structures of pyrophyllite, 1Tc, and of its dehydroxylate
American Mineralogist, 1972, 57, 732-750
9000277 CIFAl2 O11 Si4C -15.1919; 9.1224; 9.499
91.17; 100.21; 88.62
442.585Wardle, R.; Brindley, G. W.
The crystal structures of pyrophyllite, 1Tc, and of its dehydroxylate
American Mineralogist, 1972, 57, 732-750
9000288 CIFFe1.088 O8 Rb Si2.912C -18.952; 13.127; 7.359
90.05; 116.47; 89.35
774.063Brunton, G. D.; Harris, L. A.; Kopp, O. C.
Crystal structure of a rubidium iron feldspar
American Mineralogist, 1972, 57, 1720-1728
9000525 CIFAl Na O8 Si3C -18.153; 12.8694; 7.107
93.521; 116.458; 90.257
665.91Prewitt, C. T.; Sueno, S.; Papike, J. J.
The crystal structures of high albite and monalbite at high temperatures T = 24 deg C feldspar
American Mineralogist, 1976, 61, 1213-1225
9000526 CIFAl Na O8 Si3C -18.1829; 12.8947; 7.119
93.041; 116.352; 90.172
671.866Prewitt, C. T.; Sueno, S.; Papike, J. J.
The crystal structures of high albite and monalbite at high temperatures T = 350 deg C feldspar
American Mineralogist, 1976, 61, 1213-1225
9000527 CIFAl Na O8 Si3C -18.2097; 12.9182; 7.1284
92.482; 116.282; 90.128
677.019Prewitt, C. T.; Sueno, S.; Papike, J. J.
The crystal structures of high albite and monalbite at high temperatures T = 600 deg C feldspar
American Mineralogist, 1976, 61, 1213-1225
9000528 CIFAl Na O8 Si3C -18.2296; 12.9336; 7.1357
91.956; 116.232; 90.078
680.78Prewitt, C. T.; Sueno, S.; Papike, J. J.
The crystal structures of high albite and monalbite at high temperatures T = 750 deg C feldspar
American Mineralogist, 1976, 61, 1213-1225
9000529 CIFAl Na O8 Si3C -18.2508; 12.9489; 7.1431
91.161; 116.169; 90.03
684.755Prewitt, C. T.; Sueno, S.; Papike, J. J.
The crystal structures of high albite and monalbite at high temperatures T = 950 deg C feldspar
American Mineralogist, 1976, 61, 1213-1225
9000530 CIFAl Na O8 Si3C -18.2763; 12.9593; 7.1463
90.097; 116.092; 89.988
688.363Prewitt, C. T.; Sueno, S.; Papike, J. J.
The crystal structures of high albite and monalbite at high temperatures T = 1090 deg C feldspar
American Mineralogist, 1976, 61, 1213-1225
9000531 CIFAl Na O8 Si3C -18.278; 12.959; 7.145
90.1; 116.1; 90
688.316Prewitt, C. T.; Sueno, S.; Papike, J. J.
The crystal structures of high albite and monalbite at high temperatures T = 1105 deg C feldspar
American Mineralogist, 1976, 61, 1213-1225
9000584 CIFAl Na O8 Si3C -18.206; 12.817; 7.169
94; 116.4; 87.7
673.694Winter, J. K.; Ghose, S.; Okamura, F. P.
A high-temperature study of the thermal expansion and the anisotropy of the sodium atom in low albite T = 500 deg C Note: this sample of feldspar is from Tiburon, Marin County, California, USA
American Mineralogist, 1977, 62, 921-931
9000585 CIFAl Na O8 Si3C -18.242; 12.841; 7.176
93.7; 116.3; 87.6
679.366Winter, J. K.; Ghose, S.; Okamura, F. P.
A high-temperature study of the thermal expansion and the anisotropy of the sodium atom in low albite T = 750 deg C Note: this sample of feldspar is from Tiburon, Marin County, California, USA
American Mineralogist, 1977, 62, 921-931
9000586 CIFAl Na O8 Si3C -18.277; 12.86; 7.181
93.3; 116.2; 87.6
684.577Winter, J. K.; Ghose, S.; Okamura, F. P.
A high-temperature study of the thermal expansion and the anisotropy of the sodium atom in low albite T = 970 deg C Note: this sample of feldspar is from Tiburon, Marin County, California, USA
American Mineralogist, 1977, 62, 921-931
9000609 CIFCa0.96 Mn0.04 O3 SiC -110.121; 11.07; 7.312
99.51; 100.51; 83.43
791.412Ohashi, Y.; Finger, L. W.
The role of octahedral cations in pyroxenoid crystal chemistry. I. Bustamite, wollastonite, and the pectolite-schizolite-serandite series sample Mn-WO, from Broken Hill, New South Wales, Australia
American Mineralogist, 1978, 63, 274-288
9000610 CIFCa0.957 Fe0.043 O3 SiC -110.104; 11.054; 7.305
99.53; 100.56; 83.44
788.037Ohashi, Y.; Finger, L. W.
The role of octahedral cations in pyroxenoid crystal chemistry. I. Bustamite, wollastonite, and the pectolite-schizolite-serandite series sample Fe-WO, from Scawt Hill, Antrim County, Ireland
American Mineralogist, 1978, 63, 274-288
9000611 CIFCa0.34 Mn1.66 Na O9 Si3C -19.909; 10.667; 6.913
99.1; 100.51; 82.49
705.483Ohashi, Y.; Finger, L. W.
The role of octahedral cations in pyroxenoid crystal chemistry. I. Bustamite, wollastonite, and the pectolite-schizolite-serandite series sample SRN, from Rouma, Island of Los, Guinea
American Mineralogist, 1978, 63, 274-288
9000612 CIFCa1.23 Mn0.77 Na O9 Si3C -110.059; 10.88; 6.978
98.84; 100.58; 82.64
737.853Ohashi, Y.; Finger, L. W.
The role of octahedral cations in pyroxenoid crystal chemistry. I. Bustamite, wollastonite, and the pectolite-schizolite-serandite series sample SCH, from Kangerdluarsuk, Julianehaab, Greenland
American Mineralogist, 1978, 63, 274-288
9000677 CIFCa0.6 Mg0.86 Mn3.54 O15 Si5C -19.797; 10.497; 12.185
108.55; 103.02; 82.49
1155.08Peacor, D. R.; Essene, E. J.; Brown, P. E.; Winter, G. A.
The crystal chemistry and petrogenesis of a magnesian rhodonite
American Mineralogist, 1978, 63, 1137-1142
9000681 CIFAl K0.2 Na0.8 O8 Si3C -18.144; 12.989; 7.16
92.1; 116.56; 90.21
676.846Keefer, K. D.; Brown, G. E.
Crystal structures and compositions of sanidine and high albite in cryptoperthitic intergrowth Note this sample of feldspar is from the Rabb Canyon pegmatite, Grant County, New Mexico, USA
American Mineralogist, 1978, 63, 1264-1273
9000701 CIFAl K O8 Si3C -18.643; 12.929; 7.19
90.1; 116.2; 89.6
720.883Ribbe, P. H.
The structure of a strained intermediate microcline in cryptoperthitic association with twinned plagioclase feldspar
American Mineralogist, 1979, 64, 402-408
9000702 CIFAl Na O8 Si3C -18.161; 12.875; 7.11
93.53; 116.46; 90.24
667.122Winter, J. K.; Okamura, F. P.; Ghose, S.
A high-temperature structural study of high albite, monalbite, and the analbite - monalbite phase transition T = 25 C Note: this sample of feldspar is from Tiburon, Marin County, California, USA
American Mineralogist, 1979, 64, 409-423
9000703 CIFAl Na O8 Si3C -18.208; 12.934; 7.134
92.65; 116.25; 90.12
678.316Winter, J. K.; Okamura, F. P.; Ghose, S.
A high-temperature structural study of high albite, monalbite, and the analbite - monalbite phase transition T = 500 C Note: this sample of feldspar is from Tiburon, Marin County, California, USA
American Mineralogist, 1979, 64, 409-423
9000704 CIFAl Na O8 Si3C -18.234; 12.955; 7.143
92; 116.17; 90.06
683.315Winter, J. K.; Okamura, F. P.; Ghose, S.
A high-temperature structural study of high albite, monalbite, and the analbite - monalbite phase transition T = 750 C Note: this sample of feldspar is from Tiburon, Marin County, California, USA
American Mineralogist, 1979, 64, 409-423
9000705 CIFAl Na O8 Si3C -18.259; 12.975; 7.151
90.8; 116.1; 90
688.08Winter, J. K.; Okamura, F. P.; Ghose, S.
A high-temperature structural study of high albite, monalbite, and the analbite - monalbite phase transition T = 980 C Note: this sample of feldspar is from Tiburon, Marin County, California, USA
American Mineralogist, 1979, 64, 409-423
9000706 CIFAl Na O8 Si3C -18.27; 12.978; 7.154
90.22; 116.05; 89.96
689.817Winter, J. K.; Okamura, F. P.; Ghose, S.
A high-temperature structural study of high albite, monalbite, and the analbite - monalbite phase transition T = 1040 C Note: this sample of feldspar is from Tiburon, Marin County, California, USA
American Mineralogist, 1979, 64, 409-423

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