Crystallography Open Database
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COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 9013067 | CIF | Fe S2 | P n n m | 4.4446; 5.4246; 3.3864 90; 90; 90 | 81.647 | Rieder, 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 marcasite International Journal of Coal Geology, 2007, 71, 115-121 |
| 9013068 | CIF | As0.4 Fe S1.6 | P n n m | 4.449; 5.432; 3.391 90; 90; 90 | 81.95 | Rieder, 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-marcasite International Journal of Coal Geology, 2007, 71, 115-121 |
| 9013069 | CIF | Fe S2 | P a -3 | 5.416; 5.416; 5.416 90; 90; 90 | 158.868 | Rieder, 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 |
| 9013070 | CIF | As0.026 Fe S1.974 | P a -3 | 5.428; 5.428; 5.428 90; 90; 90 | 159.926 | Rieder, 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 | CIF | As0.54 Fe S1.46 | P a -3 | 5.429; 5.429; 5.429 90; 90; 90 | 160.015 | Rieder, 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 |
| 9013072 | CIF | Al3 B2 H Mg2 O10 | P 1 21/c 1 | 7.455; 4.33; 9.825 90; 110.68; 90 | 296.718 | Daniels, P.; Krosse, S.; Werding, G.; Schreyer, W. "Pseudosinhalite", a new hydrous MgAl-borate: synthesis, phase characterization, crystal structure, and PT-stability Locality: synthetic Contributions to Mineralogy and Petrology, 1997, 128, 261-271 |
| 9013073 | CIF | H2 | P 63/m m c | 3.782; 3.782; 6.167 90; 90; 120 | 76.392 | Ishmaev, S. N.; Sadikov, I. P.; Chernyshev, A. A.; Vindryevsky, B. A.; Sukhoparov, V. A.; Telepnev, A. S.; Kobelyev, G. V. Neutron structural investigations of solid para-hydrogen at pressures up to 24 kbar Sample: at T = 4.2 K Note: known as para-hydrogen Zhurnal Eksperimental'noi i Teoreticheskoi Fiziki, 1983, 84, 394-403 |
| 9013074 | CIF | H2 | P 63/m m c | 3.767; 3.767; 6.136 90; 90; 120 | 75.406 | Ishmaev, S. N.; Sadikov, I. P.; Chernyshev, A. A.; Vindryevsky, B. A.; Sukhoparov, V. A.; Telepnev, A. S.; Kobelyev, G. V. Neutron structural investigations of solid para-hydrogen at pressures up to 24 kbar Sample: at P = .00276 GPa & T = 4.2 K Note: known as para-hydrogen Zhurnal Eksperimental'noi i Teoreticheskoi Fiziki, 1983, 84, 394-403 |
| 9013075 | CIF | H2 | P 63/m m c | 3.761; 3.761; 6.154 90; 90; 120 | 75.387 | Ishmaev, S. N.; Sadikov, I. P.; Chernyshev, A. A.; Vindryevsky, B. A.; Sukhoparov, V. A.; Telepnev, A. S.; Kobelyev, G. V. Neutron structural investigations of solid para-hydrogen at pressures up to 24 kbar Sample: at P = .00235 GPa & T = 4.2 K Note: known as para-hydrogen Zhurnal Eksperimental'noi i Teoreticheskoi Fiziki, 1983, 84, 394-403 |
| 9013076 | CIF | H2 | P 63/m m c | 3.755; 3.755; 6.119 90; 90; 120 | 74.719 | Ishmaev, S. N.; Sadikov, I. P.; Chernyshev, A. A.; Vindryevsky, B. A.; Sukhoparov, V. A.; Telepnev, A. S.; Kobelyev, G. V. Neutron structural investigations of solid para-hydrogen at pressures up to 24 kbar Sample: at P = .00488 GPa & T = 4.2 K Note: known as para-hydrogen Zhurnal Eksperimental'noi i Teoreticheskoi Fiziki, 1983, 84, 394-403 |
| 9013077 | CIF | H2 | P 63/m m c | 3.72; 3.72; 6.078 90; 90; 120 | 72.841 | Ishmaev, S. N.; Sadikov, I. P.; Chernyshev, A. A.; Vindryevsky, B. A.; Sukhoparov, V. A.; Telepnev, A. S.; Kobelyev, G. V. Neutron structural investigations of solid para-hydrogen at pressures up to 24 kbar Sample: at P = .01024 GPa & T = 4.2 K Note: known as para-hydrogen Zhurnal Eksperimental'noi i Teoreticheskoi Fiziki, 1983, 84, 394-403 |
| 9013078 | CIF | H2 | P 63/m m c | 3.713; 3.713; 6.056 90; 90; 120 | 72.305 | Ishmaev, S. N.; Sadikov, I. P.; Chernyshev, A. A.; Vindryevsky, B. A.; Sukhoparov, V. A.; Telepnev, A. S.; Kobelyev, G. V. Neutron structural investigations of solid para-hydrogen at pressures up to 24 kbar Sample: at P = .01294 GPa & T = 4.2 K Note: known as para-hydrogen Zhurnal Eksperimental'noi i Teoreticheskoi Fiziki, 1983, 84, 394-403 |
| 9013079 | CIF | H2 | P 63/m m c | 3.661; 3.661; 5.972 90; 90; 120 | 69.319 | Ishmaev, S. N.; Sadikov, I. P.; Chernyshev, A. A.; Vindryevsky, B. A.; Sukhoparov, V. A.; Telepnev, A. S.; Kobelyev, G. V. Neutron structural investigations of solid para-hydrogen at pressures up to 24 kbar Sample: at P = .0253 GPa & T = 8.3 K Note: known as para-hydrogen Zhurnal Eksperimental'noi i Teoreticheskoi Fiziki, 1983, 84, 394-403 |
| 9013080 | CIF | H2 | P 63/m m c | 3.659; 3.659; 5.975 90; 90; 120 | 69.278 | Ishmaev, S. N.; Sadikov, I. P.; Chernyshev, A. A.; Vindryevsky, B. A.; Sukhoparov, V. A.; Telepnev, A. S.; Kobelyev, G. V. Neutron structural investigations of solid para-hydrogen at pressures up to 24 kbar Sample: at P = .0252 GPa & T = 8.5 K Note: known as para-hydrogen Zhurnal Eksperimental'noi i Teoreticheskoi Fiziki, 1983, 84, 394-403 |
| 9013081 | CIF | H2 | P 63/m m c | 3.619; 3.619; 5.905 90; 90; 120 | 66.977 | Ishmaev, S. N.; Sadikov, I. P.; Chernyshev, A. A.; Vindryevsky, B. A.; Sukhoparov, V. A.; Telepnev, A. S.; Kobelyev, G. V. Neutron structural investigations of solid para-hydrogen at pressures up to 24 kbar Sample: at P = .0381 GPa & T = 8.6 K Note: known as para-hydrogen Zhurnal Eksperimental'noi i Teoreticheskoi Fiziki, 1983, 84, 394-403 |
| 9013082 | CIF | H2 | P 63/m m c | 3.591; 3.591; 5.863 90; 90; 120 | 65.476 | Ishmaev, S. N.; Sadikov, I. P.; Chernyshev, A. A.; Vindryevsky, B. A.; Sukhoparov, V. A.; Telepnev, A. S.; Kobelyev, G. V. Neutron structural investigations of solid para-hydrogen at pressures up to 24 kbar Sample: at P = .0488 GPa & T = 10.0 K Note: known as para-hydrogen Zhurnal Eksperimental'noi i Teoreticheskoi Fiziki, 1983, 84, 394-403 |
| 9013083 | CIF | H2 | P 63/m m c | 3.435; 3.435; 5.594 90; 90; 120 | 57.162 | Ishmaev, S. N.; Sadikov, I. P.; Chernyshev, A. A.; Vindryevsky, B. A.; Sukhoparov, V. A.; Telepnev, A. S.; Kobelyev, G. V. Neutron structural investigations of solid para-hydrogen at pressures up to 24 kbar Sample: at P = .140 GPa & T = 17.3 K Note: known as para-hydrogen Zhurnal Eksperimental'noi i Teoreticheskoi Fiziki, 1983, 84, 394-403 |
| 9013084 | CIF | H2 | P 63/m m c | 3.3; 3.3; 5.366 90; 90; 120 | 50.607 | Ishmaev, S. N.; Sadikov, I. P.; Chernyshev, A. A.; Vindryevsky, B. A.; Sukhoparov, V. A.; Telepnev, A. S.; Kobelyev, G. V. Neutron structural investigations of solid para-hydrogen at pressures up to 24 kbar Sample: at P = .300 GPa & T = 16.6 K Note: known as para-hydrogen Zhurnal Eksperimental'noi i Teoreticheskoi Fiziki, 1983, 84, 394-403 |
| 9013085 | CIF | H2 | P 63/m m c | 3.207; 3.207; 5.206 90; 90; 120 | 46.37 | Ishmaev, S. N.; Sadikov, I. P.; Chernyshev, A. A.; Vindryevsky, B. A.; Sukhoparov, V. A.; Telepnev, A. S.; Kobelyev, G. V. Neutron structural investigations of solid para-hydrogen at pressures up to 24 kbar Sample: at P = .480 GPa & T = 16.6 K Note: known as para-hydrogen Zhurnal Eksperimental'noi i Teoreticheskoi Fiziki, 1983, 84, 394-403 |
| 9013086 | CIF | H2 | P 63/m m c | 3.119; 3.119; 5.086 90; 90; 120 | 42.849 | Ishmaev, S. N.; Sadikov, I. P.; Chernyshev, A. A.; Vindryevsky, B. A.; Sukhoparov, V. A.; Telepnev, A. S.; Kobelyev, G. V. Neutron structural investigations of solid para-hydrogen at pressures up to 24 kbar Sample: at P = .70 GPa & T = 16.0 K Note: known as para-hydrogen Zhurnal Eksperimental'noi i Teoreticheskoi Fiziki, 1983, 84, 394-403 |
| 9013087 | CIF | H2 | P 63/m m c | 3.059; 3.059; 4.993 90; 90; 120 | 40.462 | Ishmaev, S. N.; Sadikov, I. P.; Chernyshev, A. A.; Vindryevsky, B. A.; Sukhoparov, V. A.; Telepnev, A. S.; Kobelyev, G. V. Neutron structural investigations of solid para-hydrogen at pressures up to 24 kbar Sample: at P = .94 GPa & T = 16.5 K Note: known as para-hydrogen Zhurnal Eksperimental'noi i Teoreticheskoi Fiziki, 1983, 84, 394-403 |
| 9013088 | CIF | H2 | P 63/m m c | 2.998; 2.998; 4.893 90; 90; 120 | 38.086 | Ishmaev, S. N.; Sadikov, I. P.; Chernyshev, A. A.; Vindryevsky, B. A.; Sukhoparov, V. A.; Telepnev, A. S.; Kobelyev, G. V. Neutron structural investigations of solid para-hydrogen at pressures up to 24 kbar Sample: at P = 1.19 GPa & T = 16.8 K Note: known as para-hydrogen Zhurnal Eksperimental'noi i Teoreticheskoi Fiziki, 1983, 84, 394-403 |
| 9013089 | CIF | H2 | P 63/m m c | 2.979; 2.979; 4.853 90; 90; 120 | 37.298 | Ishmaev, S. N.; Sadikov, I. P.; Chernyshev, A. A.; Vindryevsky, B. A.; Sukhoparov, V. A.; Telepnev, A. S.; Kobelyev, G. V. Neutron structural investigations of solid para-hydrogen at pressures up to 24 kbar Sample: at P = 1.38 GPa & T = 16.2 K Note: known as para-hydrogen Zhurnal Eksperimental'noi i Teoreticheskoi Fiziki, 1983, 84, 394-403 |
| 9013090 | CIF | H2 | P 63/m m c | 2.953; 2.953; 4.809 90; 90; 120 | 36.317 | Ishmaev, S. N.; Sadikov, I. P.; Chernyshev, A. A.; Vindryevsky, B. A.; Sukhoparov, V. A.; Telepnev, A. S.; Kobelyev, G. V. Neutron structural investigations of solid para-hydrogen at pressures up to 24 kbar Sample: at P = 1.51 GPa & T = 16.5 K Note: known as para-hydrogen Zhurnal Eksperimental'noi i Teoreticheskoi Fiziki, 1983, 84, 394-403 |
| 9013091 | CIF | H2 | P 63/m m c | 2.929; 2.929; 4.78 90; 90; 120 | 35.514 | Ishmaev, S. N.; Sadikov, I. P.; Chernyshev, A. A.; Vindryevsky, B. A.; Sukhoparov, V. A.; Telepnev, A. S.; Kobelyev, G. V. Neutron structural investigations of solid para-hydrogen at pressures up to 24 kbar Sample: at P = 1.69 GPa & T = 16.4 K Note: known as para-hydrogen Zhurnal Eksperimental'noi i Teoreticheskoi Fiziki, 1983, 84, 394-403 |
| 9013092 | CIF | H2 | P 63/m m c | 2.85; 2.85; 4.64 90; 90; 120 | 32.639 | Ishmaev, S. N.; Sadikov, I. P.; Chernyshev, A. A.; Vindryevsky, B. A.; Sukhoparov, V. A.; Telepnev, A. S.; Kobelyev, G. V. Neutron structural investigations of solid para-hydrogen at pressures up to 24 kbar Sample: at P = 2.40 GPa & T = 25.5 K Note: known as para-hydrogen Zhurnal Eksperimental'noi i Teoreticheskoi Fiziki, 1983, 84, 394-403 |
| 9013093 | CIF | Mg2 O4 Si | P b n m | 4.7503; 10.187; 5.9771 90; 90; 90 | 289.24 | Takeuchi, Y.; Yamanaka, T.; Haga, N.; Hirano, M. High-temperature crystallography of olivines and spinels T = 25 degree C Materials Science of the Earth's Interior, edited by Sunagawa, 1984, 1984, 191-231 |
| 9013094 | CIF | Mg2 O4 Si | P b n m | 4.758; 10.219; 5.9899 90; 90; 90 | 291.241 | Takeuchi, Y.; Yamanaka, T.; Haga, N.; Hirano, M. High-temperature crystallography of olivines and spinels T = 310 degree C Materials Science of the Earth's Interior, edited by Sunagawa, 1984, 1984, 191-231 |
| 9013095 | CIF | Mg2 O4 Si | P b n m | 4.767; 10.248; 6.0059 90; 90; 90 | 293.402 | Takeuchi, Y.; Yamanaka, T.; Haga, N.; Hirano, M. High-temperature crystallography of olivines and spinels T = 530 degree C Materials Science of the Earth's Interior, edited by Sunagawa, 1984, 1984, 191-231 |
| 9013096 | CIF | Mg2 O4 Si | P b n m | 4.777; 10.269; 6.0184 90; 90; 90 | 295.233 | Takeuchi, Y.; Yamanaka, T.; Haga, N.; Hirano, M. High-temperature crystallography of olivines and spinels T = 700 degree C Materials Science of the Earth's Interior, edited by Sunagawa, 1984, 1984, 191-231 |
| 9013097 | CIF | Mg2 O4 Si | P b n m | 4.789; 10.321; 6.045 90; 90; 90 | 298.788 | Takeuchi, Y.; Yamanaka, T.; Haga, N.; Hirano, M. High-temperature crystallography of olivines and spinels T = 950 degree C Materials Science of the Earth's Interior, edited by Sunagawa, 1984, 1984, 191-231 |
| 9013098 | CIF | Mg2 O4 Si | P b n m | 4.7951; 10.343; 6.0571 90; 90; 90 | 300.406 | Takeuchi, Y.; Yamanaka, T.; Haga, N.; Hirano, M. High-temperature crystallography of olivines and spinels T = 1050 degree C Materials Science of the Earth's Interior, edited by Sunagawa, 1984, 1984, 191-231 |
| 9013099 | CIF | Mg2 O4 Si | P b n m | 4.808; 10.378; 6.077 90; 90; 90 | 303.227 | Takeuchi, Y.; Yamanaka, T.; Haga, N.; Hirano, M. High-temperature crystallography of olivines and spinels T = 1210 degree C Materials Science of the Earth's Interior, edited by Sunagawa, 1984, 1984, 191-231 |
| 9013100 | CIF | Mg2 O4 Si | P b n m | 4.819; 10.424; 6.099 90; 90; 90 | 306.373 | Takeuchi, Y.; Yamanaka, T.; Haga, N.; Hirano, M. High-temperature crystallography of olivines and spinels T = 1400 degree C Materials Science of the Earth's Interior, edited by Sunagawa, 1984, 1984, 191-231 |
| 9013101 | CIF | Mg2 O4 Si | P b n m | 4.834; 10.455; 6.1147 90; 90; 90 | 309.034 | Takeuchi, Y.; Yamanaka, T.; Haga, N.; Hirano, M. High-temperature crystallography of olivines and spinels T = 1600 degree C Materials Science of the Earth's Interior, edited by Sunagawa, 1984, 1984, 191-231 |
| 9013102 | CIF | Si | F d -3 m :1 | 5.4304; 5.4304; 5.4304 90; 90; 90 | 160.138 | Dutta, B. N. Lattice constants and thermal expansion of silicon up to 900 C by X-ray method Locality: synthetic Sample: at T = 25 C Physica Status Solidi, 1962, 2, 984-987 |
| 9013103 | CIF | Si | F d -3 m :1 | 5.437; 5.437; 5.437 90; 90; 90 | 160.723 | Dutta, B. N. Lattice constants and thermal expansion of silicon up to 900 C by X-ray method Locality: synthetic Sample: at T = 345 C Physica Status Solidi, 1962, 2, 984-987 |
| 9013104 | CIF | Si | F d -3 m :1 | 5.441; 5.441; 5.441 90; 90; 90 | 161.078 | Dutta, B. N. Lattice constants and thermal expansion of silicon up to 900 C by X-ray method Locality: synthetic Sample: at T = 525 C Physica Status Solidi, 1962, 2, 984-987 |
| 9013105 | CIF | Si | F d -3 m :1 | 5.4432; 5.4432; 5.4432 90; 90; 90 | 161.273 | Dutta, B. N. Lattice constants and thermal expansion of silicon up to 900 C by X-ray method Locality: synthetic Sample: at T = 615 C Physica Status Solidi, 1962, 2, 984-987 |
| 9013106 | CIF | Si | F d -3 m :1 | 5.4455; 5.4455; 5.4455 90; 90; 90 | 161.478 | Dutta, B. N. Lattice constants and thermal expansion of silicon up to 900 C by X-ray method Locality: synthetic Sample: at T = 700 C Physica Status Solidi, 1962, 2, 984-987 |
| 9013107 | CIF | Si | F d -3 m :1 | 5.448; 5.448; 5.448 90; 90; 90 | 161.7 | Dutta, B. N. Lattice constants and thermal expansion of silicon up to 900 C by X-ray method Locality: synthetic Sample: at T = 785 C Physica Status Solidi, 1962, 2, 984-987 |
| 9013108 | CIF | Si | F d -3 m :1 | 5.4515; 5.4515; 5.4515 90; 90; 90 | 162.012 | Dutta, B. N. Lattice constants and thermal expansion of silicon up to 900 C by X-ray method Locality: synthetic Sample: at T = 878 C Physica Status Solidi, 1962, 2, 984-987 |
| 9013109 | CIF | Ge | C m c e | 7.886; 4.656; 4.667 90; 90; 90 | 171.359 | Takemura, K.; Schwarz, U.; Syassen, K.; Christensen, N. E.; Hanfland, M.; Novikov, D. L.; Loa, I. High-pressure structures of Ge above 100 GPa Locality: sytnthetic Sample: at P = 135 GPa Note: structure theoretically calculated based on experimental data Physica Status Solidi B, 2001, 223, 385-390 |
| 9013110 | CIF | P4 | P -1 | 11.45; 5.503; 11.261 71.84; 90.37; 71.56 | 635.231 | Simon, A.; Borrmann, H.; Craubner, H. Crystal structure of ordered white phosphorus (β-P) Sample: at T = 158.15 K Note: beta phase; transforms from alpha phase at T = 196.75 K Phosphorus and Sulfur and the Related Elements, 1987, 30, 507-510 |
| 9013111 | CIF | Be | P 21 21 2 | 2.168; 3.755; 3.416 90; 90; 90 | 27.809 | Vijayakumar, V.; Godwal, B. K.; Vohra, Y. K.; Sikka, S. K.; Chidambaram, R. On the high-pressure phase transition in beryllium metal Sample: at P = 28.3 GPa Note: phase II Journal of Physics F: Metal Physics, 1984, 14, L65-L68 |
| 9013112 | CIF | Al0.1 Ce0.154 Fe0.22 O22 Si4 Sr3.846 Ti3.68 Zr | C 1 2/m 1 | 13.983; 5.6722; 11.996 90; 114.215; 90 | 867.739 | Miyawaki, R.; Matsubara, S.; Miyajima, H. The crystal structure of rengeite, Sr4ZrTi4(Si2O7)2O8 Sample: C2/m refinement Journal of Mineralogical and Petrological Sciences, 2002, 97, 7-12 |
| 9013113 | CIF | Al0.1 Ce0.158 Fe0.2 O22 Si4 Sr3.842 Ti3.7 Zr | P 1 21/a 1 | 13.983; 5.6722; 11.996 90; 114.215; 90 | 867.739 | Miyawaki, R.; Matsubara, S.; Miyajima, H. The crystal structure of rengeite, Sr4ZrTi4(Si2O7)2O8 Sample: P2_1/a refinement Journal of Mineralogical and Petrological Sciences, 2002, 97, 7-12 |
| 9013114 | CIF | Ba0.05 K0.95 Li Mg0.431 Mn1.569 Na2 O24 Si8 Ti0.34 V1.66 | C 1 c 1 | 16.45; 12.492; 9.995 90; 115.32; 90 | 1856.59 | Matsubara, S.; Miyawaki, R.; Kurosawa, M.; Suzuki, Y. Watatsumiite, KNa2LiMn2V2Si8O24, a new mineral from the Tanohata mine, Iwate Prefecture, Japan Locality: metamorphosed manganese ore deposit, Tanohata mine, Iwate Prefecture, Japan Journal of Mineralogical and Petrological Sciences, 2003, 98, 142-150 |
| 9013115 | CIF | Fe1.345 Mn0.559 Nb1.691 O10 Sn0.016 Ta0.351 Ti0.102 W0.919 | P b c n | 23.706; 5.723; 5.045 90; 90; 90 | 684.452 | Zhizhong, P.; Su, W.; Zhesheng, M.; Guangming, Y. The crystal structure of qitianlingite (Fe2Nb2WO10) Kexue Tongbao, 1988, 33, 856-861 |
| 9013116 | CIF | Br2 | C m c e | 6.5672; 4.4678; 8.6938 90; 90; 90 | 255.084 | Powell, B. M.; Heal, K. M.; Torrie, B. H. The temperature dependence of the crystal structures of the solid halogens, bromine and chlorine Locality: synthetic Sample: at T = 5 K Molecular Physics, 1984, 53, 929-939 |
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