Crystallography Open Database

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9009218 CIFO2 SiP a -33.9299; 3.9299; 3.9299
90; 90; 90		60.694Kuwayama, Y.; Hirose, K.; Sata, N.; Ohishi, Y.
The pyrite-type high-pressure form of silica Sample: P = 271 GPa, T = 300 K
Science, 2005, 309, 923-925
2022864 CIF
HKL
Paper		N2 SiP a -34.1205; 4.1205; 4.1205
90; 90; 90		69.96Jurzick, Pascal L.; Krach, Georg; Brüning, Lukas; Schnick, Wolfgang; Bykov, Maxim
Synthesis and crystal structure of silicon pernitride SiN2 at 140 GPa
Acta Crystallographica Section E Crystallographic Communications, 2023, 79
2104027 CIF
Paper		Ge O2P a -34.3365; 4.3365; 4.3365
90; 90; 90		81.55Shiraki, Koichi; Tsuchiya, Taku; Ono, Shigeaki
Structural refinements of high-pressure phases in germanium dioxide
Acta Crystallographica Section B, 2003, 59, 701-708
1525835 CIFGe O2P a -34.4046; 4.4046; 4.4046
90; 90; 90		85.451Lodziana, Z.; Parlinski, K.; Hafner, J.
Ab initio studies of high-pressure transformations in Ge O2
Physical Review, Serie 3. B - Condensed Matter (18,1978-), 2001, 63, 1341061-1341067
1526236 CIFF2 MgP a -34.7615; 4.7615; 4.7615
90; 90; 90		107.952Haines, J.; Klug, D.D.; Leger, J.M.; Gorelli, F.; Tse, J.S.; Li, Z.Q.
X-ray diffraction and theoretical studies of the high-pressure structures and phase transitions in magnesium fluoride
Physical Review, Serie 3. B - Condensed Matter (18,1978-), 2001, 64, 1341101-13411010
1540048 CIFO2 RuP a -34.85892; 4.85892; 4.85892
90; 90; 90		114.715Haines, J.; Leger, J.M.; Schmidt, M.W.; da Jornada, J.A.H.; Petitet, J.P.; Pereira, A.S.; Hull, S.
Structural characterisation of the Pa3- -type, high pressure phase of ruthenium dioxide
Journal of Physics and Chemistry of Solids, 1998, 59, 239-243
1542235 CIFDP a -35.084; 5.084; 5.084
90; 90; 90		131.406Mucker, K.F.; White, D.; Talhouk, S.; Harris, P.M.
Crystal Structure of Para-enriched Solid Deuterium Below the lambda Transition
Physical Review Letters, 1966, 16, 799-801
1539433 CIFCd H0.24 O2P a -35.273; 5.273; 5.273
90; 90; 90		146.613Vannerberg, N.G.
On the formation and structure of cadmium peroxides
Arkiv foer Kemi, 1956, 10, 455-459
1008245 CIFF2 PdP a -35.329; 5.329; 5.329
90; 90; 90		151.3Tressaud, A; Soubeyroux, J L; Touhara, H; Demazeau, G; Langlais, F
On a new structural type of fluorine compounds: crystal and magnetic structures of a high pressure form of Pd F~2~
Materials Research Bulletin, 1981, 16, 207-214
1544893 CIFFe S2P a -35.3702; 5.3702; 5.3702
90; 90; 90		154.87Fujii, T.; Yoshida, A.; Tanaka, K.; Marumo, F.; Noda, Y.
High pressure compressibilities of pyrite and cattierite Sample: FeS2 at 4.2 GPa
Mineralogical Journal, 1986, 13, 202-211
9010011 CIFFe S2P a -35.38; 5.38; 5.38
90; 90; 90		155.721Ramsdell, L. S.
The crystal structures of some metallic sulfides
American Mineralogist, 1925, 10, 281-304
1544892 CIFFe S2P a -35.3825; 5.3825; 5.3825
90; 90; 90		155.94Fujii, T.; Yoshida, A.; Tanaka, K.; Marumo, F.; Noda, Y.
High pressure compressibilities of pyrite and cattierite Sample: FeS2 at 3.1 GPa
Mineralogical Journal, 1986, 13, 202-211
1564890 CIFFe S2P a -35.41027; 5.41027; 5.41027
90; 90; 90		158.364Ma, KeYuan; Lefèvre, Robin; Li, Qingtian; Lago, Jorge; Blacque, Olivier; Yang, Wanli; von Rohr, Fabian O.
Synthetic control over polymorph formation in the d-band semiconductor system FeS2
Chemical Science, 2021
9015842 CIFFe S2P a -35.414; 5.414; 5.414
90; 90; 90		158.692Oftedal, I.
Uber die Kristallstrukturen der verbindungen RuS2, OsS2, MnTe2 und AuSb2. Mit einem Anhang uber die Gitterkonstant von Pyrit
Zeitschrift fur Physikalische Chemie, 1928, 135, 291-299
9013069 CIFFe S2P a -35.416; 5.416; 5.416
90; 90; 90		158.868Rieder, M.; Crelling, J. C.; Sustai, O.; Drabek, M.; Weiss, Z.; Klementova, M.
Arsenic in iron disulfides in a brown coal from the North Bohemian Basin, Czech Republic Sample: As-free pyrite
International Journal of Coal Geology, 2007, 71, 115-121
9000594 CIFFe S2P a -35.4166; 5.4166; 5.4166
90; 90; 90		158.921Bayliss, P.
Crystal structure refinement of a weakly anisotropic pyrite cubic model
American Mineralogist, 1977, 62, 1168-1172
1544891 CIFFe S2P a -35.417; 5.417; 5.417
90; 90; 90		158.956Fujii, T.; Yoshida, A.; Tanaka, K.; Marumo, F.; Noda, Y.
High pressure compressibilities of pyrite and cattierite Sample: FeS2 at 1 atm
Mineralogical Journal, 1986, 13, 202-211
5000115 CIFFe S2P a -35.4179; 5.4179; 5.4179
90; 90; 90		159Brostigen, G; Kjekshus, A
Redetermined crystal structure of Fe S2 (pyrite)
Acta Chemica Scandinavica (1-27,1973-42,1988), 1969, 23, 2186-2188
7700358 CIFFe S2P a -35.4178; 5.4178; 5.4178
90; 90; 90		159.026Zuñiga-Puelles, E; Cardoso-Gil, R; Bobnar, M.; Veremchuk, I.; Himcinschi, C.; Hennig, C.; Kortus, J.; Heide, G.; Gumeniuk, R.
Structural stability and thermoelectric performance of high quality synthetic and natural pyrites (FeS<sub>2</sub>).
Dalton transactions (Cambridge, England : 2003), 2019, 48, 10703-10713
9013070 CIFAs0.026 Fe S1.974P a -35.428; 5.428; 5.428
90; 90; 90		159.926Rieder, M.; Crelling, J. C.; Sustai, O.; Drabek, M.; Weiss, Z.; Klementova, M.
Arsenic in iron disulfides in a brown coal from the North Bohemian Basin, Czech Republic Sample: As-pyrite
International Journal of Coal Geology, 2007, 71, 115-121
9013071 CIFAs0.54 Fe S1.46P a -35.429; 5.429; 5.429
90; 90; 90		160.015Rieder, M.; Crelling, J. C.; Sustai, O.; Drabek, M.; Weiss, Z.; Klementova, M.
Arsenic in iron disulfides in a brown coal from the North Bohemian Basin, Czech Republic Sample: natural As-pyrite
International Journal of Coal Geology, 2007, 71, 115-121
1535652 CIFF4 Hg PdP a -35.43; 5.43; 5.43
90; 90; 90		160.103Mueller, B.G.
Zur Struktur von Ca Pd F4, Cd Pd F4, Hg Pd F4 und HP-Pd F2
Journal of Fluorine Chemistry, 1982, 20, 291-299
4003029 CIFNi P2P a -35.4475; 5.4475; 5.4475
90; 90; 90		161.656Owens-Baird, Bryan; Xu, Junyuan; Petrovykh, Dmitri Y.; Bondarchuk, Oleksandr; Ziouani, Yasmine; González-Ballesteros, Noelia; Yox, Philip; Sapountzi, Foteini M.; Niemantsverdriet, Hans; Kolen’ko, Yury V.; Kovnir, Kirill
NiP2: A Story of Two Divergent Polymorphic Multifunctional Materials
Chemistry of Materials, 2019, 31, 3407
9012503 CIFNi P2P a -35.4706; 5.4706; 5.4706
90; 90; 90		163.721Donohue, P. C.; Bither, T. A.; Young, H. S.
High-pressure synthesis of pyrite-type nickel diphosphide and nickel diarsenide Locality: synthetic
Inorganic Chemistry, 1968, 7, 998-1001
9012266 CIFNi P1.86 Se0.14P a -35.479; 5.479; 5.479
90; 90; 90		164.477Foecker, A. J.; Jeitschko, W.
The atomic order of the pnictogen and chalcogen atoms in equiatomic ternary compounds TPnCh (T = Ni, Pd; Pn = P, As, Sb; Ch = S, Se, Te)
Journal of Solid State Chemistry, 2001, 162, 69-78
1544896 CIFCo S2P a -35.4799; 5.4799; 5.4799
90; 90; 90		164.56Fujii, T.; Yoshida, A.; Tanaka, K.; Marumo, F.; Noda, Y.
High pressure compressibilities of pyrite and cattierite Sample: CoS2 at 3.6 GPa
Mineralogical Journal, 1986, 13, 202-211
2007414 CIFC O2P a -35.4942; 5.4942; 5.4942
90; 90; 90		165.85Downs, R. T.; Somayazulu, M. S.
Carbon dioxide at 1.0 GPa
Acta Crystallographica, Section C: Crystal Structure Communications, 1998, 54, 897-898
1544895 CIFCo S2P a -35.5068; 5.5068; 5.5068
90; 90; 90		166.993Fujii, T.; Yoshida, A.; Tanaka, K.; Marumo, F.; Noda, Y.
High pressure compressibilities of pyrite and cattierite Sample: CoS2 at 1.9 GPa
Mineralogical Journal, 1986, 13, 202-211
1544894 CIFCo S2P a -35.5348; 5.5348; 5.5348
90; 90; 90		169.55Fujii, T.; Yoshida, A.; Tanaka, K.; Marumo, F.; Noda, Y.
High pressure compressibilities of pyrite and cattierite Sample: CoS2 at 1 atm
Mineralogical Journal, 1986, 13, 202-211
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
9008393 CIFCo S2P a -35.5385; 5.5385; 5.5385
90; 90; 90		169.893Nowack, E.; Schwarzenbach, D.; Gonschorek, W.; Hahn, T.
Deformationsdichten in CoS2 und NiS2 mit pyritstruktur Note: T = 295 K Note: pyrite structure
Zeitschrift fur Kristallographie, 1989, 186, 213-215
9008284 CIFCo0.8 Fe0.11 Ni0.09 S2P a -35.5387; 5.5387; 5.5387
90; 90; 90		169.912Pratt, J. L.; Bayliss, P.
Crystal-structure refinement of cattierite Note: pyrite structure
Zeitschrift fur Kristallographie, 1979, 150, 163-167
9006171 CIFCu0.6 Fe0.4 S2P a -35.5624; 5.5624; 5.5624
90; 90; 90		172.102Schmid-Beurmann P; Lottermoser, W.
57Fe-Moessbauer spectra, electronic and crystal structure of members of the CuS2-FeS2 solid solution series
Physics and Chemistry of Minerals, 1993, 19, 571-577
5910087 CIFRh S2P a -35.57; 5.57; 5.57
90; 90; 90		172.809Wyckoff, R. W. G.
Pages 234 & 238 from the second edition of Structure of Crystals by Wyckoff. Published by The Chemical Catalog Company, INC, New York in 1931.
The second edition of Structure of Crystals, 1931, 234-238
9014377 CIFRu S2P a -35.57; 5.57; 5.57
90; 90; 90		172.809Oftedal, I.
Uber die Kristallstrukturen der verbindungen RuS2, OsS2, MnTe2 und AuSb2. Mit einem Anhang uber die Gitterkonstant von Pyrit
Zeitschrift fur Physikalische Chemie, 1928, 135, 291-299
1544741 CIFNi S2P a -35.5745; 5.5745; 5.5745
90; 90; 90		173.23Fujii, T.; Tanaka, K.; Marumo, F.; Noda, Y.
Structural behaviour of NiS2 up to 54 kbar :Sample at 54 kbar
Mineralogical Journal, 1987, 13, 448-454
9000134 CIFAs Co SP a -35.582; 5.582; 5.582
90; 90; 90		173.928Giese, R. F.; Kerr, P. F.
The crystal structures of ordered and disordered cobaltite disordered, annealed after heating in a vacuum to 850 C
American Mineralogist, 1965, 50, 1002-1014
1539204 CIFRh S2P a -35.585; 5.585; 5.585
90; 90; 90		174.209Thomassen, L.
Ueber Kristallstrukturen einiqer binaerer Verbindungen der Platinmetalle II
Zeitschrift fuer Physikalische Chemie, Abteilung B: Chemie der Elementarprozesse, Aufbau der Materie, 1929, 4, 277-287
9001249 CIFCu0.7 Fe0.3 S2P a -35.585; 5.585; 5.585
90; 90; 90		174.209Bayliss, P.
Crystal chemistry and crystallography of some minerals within the pyrite group
American Mineralogist, 1989, 74, 1168-1176
1544740 CIFNi S2P a -35.5852; 5.5852; 5.5852
90; 90; 90		174.23Fujii, T.; Tanaka, K.; Marumo, F.; Noda, Y.
Structural behaviour of NiS2 up to 54 kbar :Sample at 49 kbar
Mineralogical Journal, 1987, 13, 448-454
1538443 CIFAs Co SP a -35.59; 5.59; 5.59
90; 90; 90		174.677Onorato, E.
Roentgenographische Untersuchungen ueber den Kobaltglanz
Neues Jahrbuch fuer Mineralogie. Abhandlungen (Band-Nr) (1950-), 1957, 91, 41-51
9007833 CIFRu S4P a -35.6106; 5.6106; 5.6106
90; 90; 90		176.615Lutz, H. D.; Muller, B.; Schmidt, T.; Stingl, T.
Structure refinement of pyrite-type ruthenium disulfide, RuS2, and ruthenium diselenide, RuSe2
Acta Crystallographica, Section C, 1990, 46, 2003-2005
9016356 CIFRu S2P a -35.6106; 5.6106; 5.6106
90; 90; 90		176.615Lutz, H. D.; Muller, B.; Schmidt, T.; Stingl, T.
Structure refinement of pyrite-type ruthenium disulfide, RuS2, and ruthenium diselenide, RuSe2
Acta Crystallographica, Section C, 1990, 46, 2003-2005
1538838 CIFOs S2P a -35.6188; 5.6188; 5.6188
90; 90; 90		177.391Meisel, K.
Ueber die Gitterkonstante des Os S2
Zeitschrift fuer Anorganische und Allgemeine Chemie, 1934, 219, 141-141
9008419 CIFOs S2P a -35.6194; 5.6194; 5.6194
90; 90; 90		177.447Stingl, T.; Muller, B.; Lutz, H. D.
Crystal structure refinement of osmium(II) disulfide, OsS2
Zeitschrift fur Kristallographie, 1992, 202, 161-162
1544739 CIFNi S2P a -35.6196; 5.6196; 5.6196
90; 90; 90		177.47Fujii, T.; Tanaka, K.; Marumo, F.; Noda, Y.
Structural behaviour of NiS2 up to 54 kbar :Sample at 32 kbar
Mineralogical Journal, 1987, 13, 448-454
1010489 CIFC O2P a -35.62; 5.62; 5.62
90; 90; 90		177.5Mark, H.; Pohland, E.
Das Gitter des festen Kohlendioxyds
Zeitschrift für Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie, 1924, 61, 293-298
1010492 CIFC O2P a -35.62; 5.62; 5.62
90; 90; 90		177.5de Smedt, J.; Keesom, W. H.
Das Gitter des festen Kohlendioxyds
Zeitschrift für Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie, 1925, 62, 312-313
1010498 CIFC O2P a -35.62; 5.62; 5.62
90; 90; 90		177.5Mark, H; Pohland, E
Zur Kristallstruktur des festen Kohlendioxyds.
Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977), 1926, 63, 113-114
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

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