Crystallography Open Database
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COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 9011583 | CIF | Bi7.89 Cu0.888 Fe1.112 Pb12 S35 Sb6.11 | P n n m | 22.575; 34.104; 4.038 90; 90; 90 | 3108.85 | Miehe, G. Crystal structure of kobellite Nature Physical Science, 1971, 231, 133-134 |
| 9011584 | CIF | B H13 Mg5 O10.4 | I 1 2/m 1 | 13.46; 3.1; 18.17 90; 91.6; 90 | 757.866 | Moore, P. B.; Araki, T. Wightmanite, Mg5(O)(OH)5(BO3)*nH2O, a natural drainpipe Nature Physical Science, 1972, 236, 25-26 |
| 9011585 | CIF | Ca9.267 Fe0.2 Mg0.8 O28 P7 | R 3 c :H | 10.324; 10.324; 37.103 90; 90; 120 | 3424.8 | Gopal, R.; Calvo, C. Structural relationship of whitlockite and beta-Ca3(PO4)2 Sample: Heated Nature Physical Science, 1972, 237, 30-32 |
| 9011586 | CIF | Ca9.083 Fe0.2 Mg0.8 O28 P7 | R 3 c :H | 10.33; 10.33; 37.103 90; 90; 120 | 3428.78 | Gopal, R.; Calvo, C. Structural relationship of whitlockite and beta-Ca3(PO4)2 Sample: Unheated, T = 293 K, hexagonal cell Note: CaIIB1(z) changed Nature Physical Science, 1972, 237, 30-32 |
| 9011587 | CIF | Al B3 Ca O7 | C m m a | 7.97; 11.722; 4.374 90; 90; 90 | 408.638 | Moore, P. B.; Araki, T. Johachidolite, CaAl[B3O7], a borate with very dense atomic structure Nature Physical Science, 1972, 240, 63-65 |
| 9011588 | CIF | Fe2 O4 Si | P b n m | 4.822; 10.488; 6.094 90; 90; 90 | 308.193 | Kudoh, Y.; Takeda, H. Single crystal X-ray diffraction study on the bond compressibility of fayalite, Fe~2~SiO~4~ and rutile, TiO~2~ under high pressure Sample: P = 0.001 kbar Physica B+C, 1986, 140, 333-336 |
| 9011589 | CIF | Fe2 O4 Si | P b n m | 4.793; 10.31; 6.041 90; 90; 90 | 298.521 | Kudoh, Y.; Takeda, H. Single crystal X-ray diffraction study on the bond compressibility of fayalite, Fe~2~SiO~4~ and rutile, TiO~2~ under high pressure Sample: P = 49 kbar Physica B+C, 1986, 140, 333-336 |
| 9011590 | CIF | Fe2 O4 Si | P b n m | 4.773; 10.252; 6.026 90; 90; 90 | 294.869 | Kudoh, Y.; Takeda, H. Single crystal X-ray diffraction study on the bond compressibility of fayalite, Fe~2~SiO~4~ and rutile, TiO~2~ under high pressure Sample: P = 67 kbar Physica B+C, 1986, 140, 333-336 |
| 9011591 | CIF | Fe2 O4 Si | P b n m | 4.757; 10.153; 5.985 90; 90; 90 | 289.062 | Kudoh, Y.; Takeda, H. Single crystal X-ray diffraction study on the bond compressibility of fayalite, Fe~2~SiO~4~ and rutile, TiO~2~ under high pressure Sample: P = 93 kbar Physica B+C, 1986, 140, 333-336 |
| 9011592 | CIF | Fe2 O4 Si | P b n m | 4.756; 10.089; 5.976 90; 90; 90 | 286.748 | Kudoh, Y.; Takeda, H. Single crystal X-ray diffraction study on the bond compressibility of fayalite, Fe~2~SiO~4~ and rutile, TiO~2~ under high pressure Sample: P = 117 kbar Physica B+C, 1986, 140, 333-336 |
| 9011593 | CIF | Fe2 O4 Si | P b n m | 4.739; 9.899; 5.979 90; 90; 90 | 280.483 | Kudoh, Y.; Takeda, H. Single crystal X-ray diffraction study on the bond compressibility of fayalite, Fe~2~SiO~4~ and rutile, TiO~2~ under high pressure Sample: P = 140 kbar Physica B+C, 1986, 140, 333-336 |
| 9011594 | CIF | Sc | I 4/m m m | 3.758; 3.758; 4.761 90; 90; 90 | 67.238 | Akella, J.; Xu, J.; Smith, G. S. Static high pressure studies on Nd and Sc Sample: at P = 26 GPa Physica B+C, 1986, 285-288 |
| 9011595 | CIF | H2 O13 Si6 | C 1 2/m 1 | 27.5; 7.52; 9.2 90; 101; 90 | 1867.6 | Garces, J. M.; Rocke, S. C.; Crowder, C. E.; Hasha, D. L. Hypothetical structures of magadiite and sodium octosilicate and structural relationships between the layered alkali metal silicates and the mordenite- and pentasil-group zeolites Note: hypothetical model structure Note: setting changed from left- to right-handed Clays and Clay Minerals, 1988, 36, 409-418 |
| 9011596 | CIF | Cl0.5 Fe H13.75 O2.25 | R -3 m :H | 3.19; 3.19; 23.85 90; 90; 120 | 210.184 | Trolard, F.; Bourrie, G.; Abdelmoula, M.; Refait, P.; Feder, F. Fougerite, a new mineral of the pyroaurite-iowaite group: Description and crystal structure Clays and Clay Minerals, 2007, 55, 323-334 |
| 9011597 | CIF | Ni | F m -3 m | 3.52; 3.52; 3.52 90; 90; 90 | 43.614 | Hull, A. W. A new method of x-ray crystal analysis Physical Review, 1917, 10, 661-696 |
| 9011598 | CIF | Cr | I m -3 m | 2.91; 2.91; 2.91 90; 90; 90 | 24.642 | Hull, A. W.; Davey, W. P. Crystal structure of chromium Physical Review, 1919, 14, 540-540 |
| 9011599 | CIF | Zn | P 63/m m c | 2.67; 2.67; 4.966 90; 90; 120 | 30.659 | Hull, A. W.; Davey, W. P. Graphical determination of hexagonal and tetragonal crystal structures from X-ray data Physical Review, 1921, 17, 549-570 |
| 9011600 | CIF | Ti | P 63/m m c | 2.97; 2.97; 4.72 90; 90; 120 | 36.057 | Hull, A. W. Crystal structure of titanium, zirconium, cerium, thorium and osmium Physical Review, 1921, 18, 88-89 |
| 9011601 | CIF | V | I m -3 m | 3.04; 3.04; 3.04 90; 90; 90 | 28.094 | Hull, A. W. Crystal structures of vanadium, germanium and graphite Physical Review, 1922, 20, 113-113 |
| 9011602 | CIF | Al | F m -3 m | 4.046; 4.046; 4.046 90; 90; 90 | 66.233 | Davey, W. P. Lattice constants of twelve common metals Locality: synthetic Note: lattice parameter is average of runs 1 & 2 Physical Review, 1925, 25, 753-761 |
| 9011603 | CIF | Ni | F m -3 m | 3.499; 3.499; 3.499 90; 90; 90 | 42.838 | Davey, W. P. Lattice constants of twelve common metals Locality: synthetic Note: lattice parameter is average of runs 1 & 2 Physical Review, 1925, 25, 753-761 |
| 9011604 | CIF | Cu | F m -3 m | 3.597; 3.597; 3.597 90; 90; 90 | 46.539 | Davey, W. P. Lattice constants of twelve common metals Locality: synthetic Note: lattice parameter is average of runs 1,2 & 3 Physical Review, 1925, 25, 753-761 |
| 9011605 | CIF | Mo | I m -3 m | 3.142; 3.142; 3.142 90; 90; 90 | 31.018 | Davey, W. P. Lattice constants of twelve common metals Locality: synthetic Note: lattice parameter is average of runs 1 & 2 Physical Review, 1925, 25, 753-761 |
| 9011606 | CIF | Mo | I m -3 m | 3.136; 3.136; 3.136 90; 90; 90 | 30.841 | Davey, W. P. Lattice constants of twelve common metals Locality: synthetic Note: lattice parameter is average of runs 3 & 4 Physical Review, 1925, 25, 753-761 |
| 9011607 | CIF | Ag | F m -3 m | 4.079; 4.079; 4.079 90; 90; 90 | 67.867 | Davey, W. P. Lattice constants of twelve common metals Locality: synthetic Note: lattice parameter is average of runs 1 & 2 Physical Review, 1925, 25, 753-761 |
| 9011608 | CIF | Ag | F m -3 m | 4.058; 4.058; 4.058 90; 90; 90 | 66.825 | Davey, W. P. Lattice constants of twelve common metals Locality: synthetic Note: lattice parameter is average of runs 3 & 4 Physical Review, 1925, 25, 753-761 |
| 9011609 | CIF | W | I m -3 m | 3.155; 3.155; 3.155 90; 90; 90 | 31.405 | Davey, W. P. Lattice constants of twelve common metals Locality: synthetic Note: lattice parameter is average of runs 1 & 2 Physical Review, 1925, 25, 753-761 |
| 9011610 | CIF | W | I m -3 m | 3.157; 3.157; 3.157 90; 90; 90 | 31.465 | Davey, W. P. Lattice constants of twelve common metals Locality: synthetic Note: run 3 Physical Review, 1925, 25, 753-761 |
| 9011611 | CIF | W | I m -3 m | 3.158; 3.158; 3.158 90; 90; 90 | 31.495 | Davey, W. P. Lattice constants of twelve common metals Locality: synthetic Note: lattice parameter is average of runs 3 & 4 Physical Review, 1925, 25, 753-761 |
| 9011612 | CIF | Au | F m -3 m | 4.065; 4.065; 4.065 90; 90; 90 | 67.171 | Davey, W. P. Lattice constants of twelve common metals Locality: synthetic Note: lattice parameter is average of runs 1 & 2 Physical Review, 1925, 25, 753-761 |
| 9011613 | CIF | Au | F m -3 m | 4.073; 4.073; 4.073 90; 90; 90 | 67.568 | Davey, W. P. Lattice constants of twelve common metals Locality: synthetic Note: lattice parameter is average of runs 1,2 & 3 Physical Review, 1925, 25, 753-761 |
| 9011614 | CIF | Bi | P 63/m m c | 4.539; 4.539; 11.829 90; 90; 120 | 211.057 | Davey, W. P. Lattice constants of twelve common metals Locality: synthetic Note: lattice parameter is average of runs 1 & 2 Physical Review, 1925, 25, 753-761 |
| 9011615 | CIF | Co | P 63/m m c | 2.519; 2.519; 4.091 90; 90; 120 | 22.481 | Marick, L. Variation of resistance and structure of cobalt with temperature and a discussion of its photoelectric emission Sample: at room T Note: cell edge a is average of photographs 1 & 2 Physical Review, 1936, 49, 831-837 |
| 9011616 | CIF | Co | P 63/m m c | 2.527; 2.527; 4.119 90; 90; 120 | 22.779 | Marick, L. Variation of resistance and structure of cobalt with temperature and a discussion of its photoelectric emission Sample: at T = 295 C Note: photograph 3 Physical Review, 1936, 49, 831-837 |
| 9011617 | CIF | Co | P 63/m m c | 2.536; 2.536; 4.136 90; 90; 120 | 23.036 | Marick, L. Variation of resistance and structure of cobalt with temperature and a discussion of its photoelectric emission Sample: at T = 420 C Note: photograph 4 Physical Review, 1936, 49, 831-837 |
| 9011618 | CIF | Co | F m -3 m | 3.559; 3.559; 3.559 90; 90; 90 | 45.08 | Marick, L. Variation of resistance and structure of cobalt with temperature and a discussion of its photoelectric emission Sample: at room T Note: cell parameter is average of photographs 5-8 Physical Review, 1936, 49, 831-837 |
| 9011619 | CIF | Co | F m -3 m | 3.573; 3.573; 3.573 90; 90; 90 | 45.614 | Marick, L. Variation of resistance and structure of cobalt with temperature and a discussion of its photoelectric emission Sample: at T = 295 C Note: photograph 9 Physical Review, 1936, 49, 831-837 |
| 9011620 | CIF | Co | F m -3 m | 3.579; 3.579; 3.579 90; 90; 90 | 45.844 | Marick, L. Variation of resistance and structure of cobalt with temperature and a discussion of its photoelectric emission Sample: at T = 420 C Note: photograph 10 Physical Review, 1936, 49, 831-837 |
| 9011621 | CIF | Co | F m -3 m | 3.589; 3.589; 3.589 90; 90; 90 | 46.23 | Marick, L. Variation of resistance and structure of cobalt with temperature and a discussion of its photoelectric emission Sample: at T = 625 C Note: photograph 11 Physical Review, 1936, 49, 831-837 |
| 9011622 | CIF | Co | F m -3 m | 3.602; 3.602; 3.602 90; 90; 90 | 46.734 | Marick, L. Variation of resistance and structure of cobalt with temperature and a discussion of its photoelectric emission Sample: at T = 843 C Note: photograph 12 Physical Review, 1936, 49, 831-837 |
| 9011623 | CIF | Co | F m -3 m | 3.617; 3.617; 3.617 90; 90; 90 | 47.32 | Marick, L. Variation of resistance and structure of cobalt with temperature and a discussion of its photoelectric emission Sample: at T = 1099 C Note: photograph 13 Physical Review, 1936, 49, 831-837 |
| 9011624 | CIF | Co | F m -3 m | 3.628; 3.628; 3.628 90; 90; 90 | 47.753 | Marick, L. Variation of resistance and structure of cobalt with temperature and a discussion of its photoelectric emission Sample: at T = 1121 C Note: photograph 14 Physical Review, 1936, 49, 831-837 |
| 9011625 | CIF | Co | F m -3 m | 3.644; 3.644; 3.644 90; 90; 90 | 48.388 | Marick, L. Variation of resistance and structure of cobalt with temperature and a discussion of its photoelectric emission Sample: at T = 1148 C Note: photograph 15 Physical Review, 1936, 49, 831-837 |
| 9011626 | CIF | Co | F m -3 m | 3.647; 3.647; 3.647 90; 90; 90 | 48.507 | Marick, L. Variation of resistance and structure of cobalt with temperature and a discussion of its photoelectric emission Sample: at T = 1187 C Note: photograph 16 Physical Review, 1936, 49, 831-837 |
| 9011627 | CIF | Li | F m -3 m | 4.41; 4.41; 4.41 90; 90; 90 | 85.766 | Barrett, C. S. A low temperature transformation in lithium Sample: at T = -196 C Note: transformation induced by metal being plastically deformed Physical Review, 1947, 72, 245-245 |
| 9011628 | CIF | Li | I m -3 m | 3.5; 3.5; 3.5 90; 90; 90 | 42.875 | Barrett, C. S. A low temperature transformation in lithium Sample: at T = -196 C Physical Review, 1947, 72, 245-245 |
| 9011629 | CIF | Ge | F d -3 m :1 | 5.65745; 5.65745; 5.65745 90; 90; 90 | 181.077 | Smakula, A.; Kalnajs, J. Precision determination of lattice constants with a Geiger-counter X-ray diffractometer Sample: at T = 25 C Physical Review, 1955, 99, 1737-1743 |
| 9011630 | CIF | He | P 63/m m c | 3.53; 3.53; 5.76 90; 90; 120 | 62.159 | Henshaw, D. G. Structure of solid helium by neutron diffraction Sample: at T = 1.1 K and P = .007 GPa Physical Review, 1958, 109, 328-330 |
| 9011631 | CIF | He | I m -3 m | 4.01; 4.01; 4.01 90; 90; 90 | 64.481 | Schuch, A. F.; Grilly, E. R.; Mills, R. L. Structure of the alpha and beta forms of solid He Sample: at T = 1.9 K & P = .01 GPa Note: structure known as the alpha form Physical Review, 1958, 110, 775-775 |
| 9011632 | CIF | He | P 63/m m c | 3.46; 3.46; 5.6 90; 90; 120 | 58.059 | Schuch, A. F.; Grilly, E. R.; Mills, R. L. Structure of the alpha and beta forms of solid He Sample: at T = 3.3 K & P = .018 GPa Note: structure known as the beta form Physical Review, 1958, 110, 775-775 |
| 9011633 | CIF | Ne | F m -3 m | 4.462; 4.462; 4.462 90; 90; 90 | 88.836 | Bolz, L. H.; Mauer, F. A. Measurement of the lattice constants of neon isotopes in the temperature range 4-24 K Locality: synthetic Sample: at T = 4.2 K Note: this is isotope 20 Ne Physical Review, 1962, 111, 242-249 |
| 9011634 | CIF | Ne | F m -3 m | 4.454; 4.454; 4.454 90; 90; 90 | 88.359 | Bolz, L. H.; Mauer, F. A. Measurement of the lattice constants of neon isotopes in the temperature range 4-24 K Locality: synthetic Sample: at T = 4.2 K Note: this is isotope 22 Ne Physical Review, 1962, 111, 242-249 |
| 9011635 | CIF | Ar | F m -3 m | 5.25; 5.25; 5.25 90; 90; 90 | 144.703 | Henshaw, D. G. Atomic distribution in liquid and solid neon and solid argon by neutron diffraction Locality: synthetic Sample: at T = 4.2 K Physical Review, 1958, 111, 1470-1475 |
| 9011636 | CIF | He | F m -3 m | 4.242; 4.242; 4.242 90; 90; 90 | 76.333 | Schuch, A. F.; Mills, R. L. New allotropic form of He3 Sample: at T = 18.76 K & P = .171 GPa Physical Review Letters, 1961, 6, 596-597 |
| 9011637 | CIF | He | P 63/m m c | 3.046; 3.046; 4.986 90; 90; 120 | 40.063 | Schuch, A. F.; Mills, R. L. New allotropic form of He3 Sample: at T = 15.98 K & P = .136 GPa Physical Review Letters, 1961, 6, 596-597 |
| 9011638 | CIF | He | I m -3 m | 4.11; 4.11; 4.11 90; 90; 90 | 69.427 | Schuch, A. F.; Mills, R. L. Structure of the gamma form of solid He4 Sample: at T = 1.73 K & P = .003 GPa Note: structure known as gamma phase Physical Review Letters, 1962, 8, 469-470 |
| 9011639 | CIF | He | P 63/m m c | 3.65; 3.65; 5.945 90; 90; 120 | 68.591 | Schuch, A. F.; Mills, R. L. Structure of the gamma form of solid He4 Sample: at T = 1.73 K & P = .003 GPa Physical Review Letters, 1962, 8, 469-470 |
| 9011640 | CIF | S | R -3 m :H | 3.277; 3.277; 2.584 90; 90; 120 | 24.031 | Luo, H.; Greene, R. G.; Ruoff, A. L. Beta-Po phase of sulfur at 162 GPa: X-ray diffraction study to 212 GPa Sample: at P = 206.5 GPa Note: this is known as the Beta-Po phase of sulfur, stable above 162 GPa Physical Review Letters, 1993, 71, 2943-2946 |
| 9011641 | CIF | Cs | C m c e | 11.205; 6.626; 6.595 90; 90; 90 | 489.641 | Schwarz, U.; Takemura, K.; Hanfland, M.; Syassen, K. Crystal structure of cesium-V Locality: synthetic Sample: at P = 12 GPa Note: phase V Physical Review Letters, 1998, 81, 2711-2714 |
| 9011642 | CIF | Cs | C m c e | 10.879; 6.443; 6.389 90; 90; 90 | 447.827 | Schwarz, U.; Takemura, K.; Hanfland, M.; Syassen, K. Crystal structure of cesium-V Locality: synthetic Sample: at P = 19.6 GPa Note: phase V Physical Review Letters, 1998, 81, 2711-2714 |
| 9011643 | CIF | Cs | C m c e | 10.641; 6.278; 6.249 90; 90; 90 | 417.459 | Schwarz, U.; Takemura, K.; Hanfland, M.; Syassen, K. Crystal structure of cesium-V Locality: synthetic Sample: at P = 25.8 GPa Note: phase V Physical Review Letters, 1998, 81, 2711-2714 |
| 9011644 | CIF | Si | C m c e | 8.0242; 4.7961; 4.776 90; 90; 90 | 183.804 | Hanfland, M.; Schwarz, U.; Syassen, K.; Takemura, K. Crystal structure of the high-pressure phase silicon VI Locality: synthetic Sample: at P = 38.4 GPa Note: phase VI Physical Review Letters, 1999, 82, 1197-1200 |
| 9011645 | CIF | Si | C m c e | 7.9686; 4.7759; 4.7546 90; 90; 90 | 180.947 | Hanfland, M.; Schwarz, U.; Syassen, K.; Takemura, K. Crystal structure of the high-pressure phase silicon VI Locality: synthetic Sample: at P = 42.5 GPa Note: phase VI Physical Review Letters, 1999, 82, 1197-1200 |
| 9011646 | CIF | Si | C m c e | 7.92; 4.7586; 4.7361 90; 90; 90 | 178.495 | Hanfland, M.; Schwarz, U.; Syassen, K.; Takemura, K. Crystal structure of the high-pressure phase silicon VI Locality: synthetic Sample: at P = 45.5 GPa Note: phase VI Physical Review Letters, 1999, 82, 1197-1200 |
| 9011647 | CIF | O2 | P m -3 n | 6.78; 6.78; 6.78 90; 90; 90 | 311.666 | Cox, D. E.; Samuelsen, E. J.; Ceckurts, K. H. Neutron-Diffraction determination of the crystal structure and magnetic form factor of gamma-oxygen Sample: at T = 46 K Note: gamma phase, stable between 44 K & 55 K Physical Review B, 1973, 7, 3102-3111 |
| 9011648 | CIF | Se | P 31 2 1 | 4.368; 4.368; 4.958 90; 90; 120 | 81.922 | Keller, R.; Holzapfel, W. B.; Schulz, H. Effect of pressure on the atom positions in Se and Te Note: known as alpha phase with trigonal structure Physical Review B, 1977, 16, 4404-4412 |
| 9011649 | CIF | Se | P 31 2 1 | 4.052; 4.052; 5.038 90; 90; 120 | 71.635 | Keller, R.; Holzapfel, W. B.; Schulz, H. Effect of pressure on the atom positions in Se and Te Sample: at P = 2.58 GPa Note: known as alpha phase with trigonal structure Physical Review B, 1977, 16, 4404-4412 |
| 9011650 | CIF | Se | P 31 2 1 | 3.956; 3.956; 5.069 90; 90; 120 | 68.701 | Keller, R.; Holzapfel, W. B.; Schulz, H. Effect of pressure on the atom positions in Se and Te Sample: at P = 4.15 GPa Note: known as alpha phase with trigonal structure Physical Review B, 1977, 16, 4404-4412 |
| 9011651 | CIF | Se | P 31 2 1 | 3.91; 3.91; 5.08 90; 90; 120 | 67.259 | Keller, R.; Holzapfel, W. B.; Schulz, H. Effect of pressure on the atom positions in Se and Te Sample: at P = 4.99 GPa Note: known as alpha phase with trigonal structure Physical Review B, 1977, 16, 4404-4412 |
| 9011652 | CIF | Se | P 31 2 1 | 3.846; 3.846; 5.095 90; 90; 120 | 65.267 | Keller, R.; Holzapfel, W. B.; Schulz, H. Effect of pressure on the atom positions in Se and Te Sample: at P = 6.57 GPa Note: known as alpha phase with trigonal structure Physical Review B, 1977, 16, 4404-4412 |
| 9011653 | CIF | Se | P 31 2 1 | 3.81; 3.81; 5.11 90; 90; 120 | 64.239 | Keller, R.; Holzapfel, W. B.; Schulz, H. Effect of pressure on the atom positions in Se and Te Sample: at P = 7.70 GPa Note: known as alpha phase with trigonal structure Physical Review B, 1977, 16, 4404-4412 |
| 9011654 | CIF | Se | P 31 2 1 | 3.779; 3.779; 5.109 90; 90; 120 | 63.186 | Keller, R.; Holzapfel, W. B.; Schulz, H. Effect of pressure on the atom positions in Se and Te Sample: at P = 8.64 GPa Note: known as alpha phase with trigonal structure Physical Review B, 1977, 16, 4404-4412 |
| 9011655 | CIF | Sc | P 4/n m m :1 | 4.73; 4.73; 3.18 90; 90; 90 | 71.146 | Vohra, Y. K.; Grosshans, W.; Holzapfel, W. B. High-pressure phase transformation in scandium Sample: at P = 33.5 GPa Physical Review B, 1982, 25, 6019-6021 |
| 9011656 | CIF | Si | I m m a | 4.737; 4.502; 2.55 90; 90; 90 | 54.381 | McMahon, M. I.; Nelmes, R. J. New high-pressure phase of Si Sample: structure exists between 13 GPa to 18 GPa Note: intermediate structure between those of Si II and Si V Physical Review B, 1993, 47, 8337-8340 |
| 9011657 | CIF | Al N | P 63 m c | 3.11; 3.11; 4.98 90; 90; 120 | 41.714 | Xu, Y. N.; Ching, W. Y. Electronic, optical, and structural properties of some wurtzite crystals Physical Review B, 1993, 48, 4335-4351 |
| 9011658 | CIF | Ga N | P 63 m c | 3.19; 3.19; 5.189 90; 90; 120 | 45.729 | Xu, Y. N.; Ching, W. Y. Electronic, optical, and structural properties of some wurtzite crystals Physical Review B, 1993, 48, 4335-4351 |
| 9011659 | CIF | Be O | P 63 m c | 2.698; 2.698; 4.38 90; 90; 120 | 27.611 | Xu, Y. N.; Ching, W. Y. Electronic, optical, and structural properties of some wurtzite crystals Physical Review B, 1993, 48, 4335-4351 |
| 9011660 | CIF | B N | P 63 m c | 2.536; 2.536; 4.199 90; 90; 120 | 23.387 | Xu, Y. N.; Ching, W. Y. Electronic, optical, and structural properties of some wurtzite crystals Physical Review B, 1993, 48, 4335-4351 |
| 9011661 | CIF | C Si | P 63 m c | 3.076; 3.076; 5.048 90; 90; 120 | 41.364 | Xu, Y. N.; Ching, W. Y. Electronic, optical, and structural properties of some wurtzite crystals Physical Review B, 1993, 48, 4335-4351 |
| 9011662 | CIF | O Zn | P 63 m c | 3.249; 3.249; 5.207 90; 90; 120 | 47.601 | Xu, Y. N.; Ching, W. Y. Electronic, optical, and structural properties of some wurtzite crystals Physical Review B, 1993, 48, 4335-4351 |
| 9011663 | CIF | Cd S | P 63 m c | 4.137; 4.137; 6.7144 90; 90; 120 | 99.52 | Xu, Y. N.; Ching, W. Y. Electronic, optical, and structural properties of some wurtzite crystals Physical Review B, 1993, 48, 4335-4351 |
| 9011664 | CIF | Cd Se | P 63 m c | 4.2985; 4.2985; 7.0152 90; 90; 120 | 112.255 | Xu, Y. N.; Ching, W. Y. Electronic, optical, and structural properties of some wurtzite crystals Physical Review B, 1993, 48, 4335-4351 |
| 9011665 | CIF | S Zn | P 63 m c | 3.811; 3.811; 6.234 90; 90; 120 | 78.411 | Xu, Y. N.; Ching, W. Y. Electronic, optical, and structural properties of some wurtzite crystals Note: 2H polytype Physical Review B, 1993, 48, 4335-4351 |
| 9011666 | CIF | Ag Cl | F m -3 m | 5.5463; 5.5463; 5.5463 90; 90; 90 | 170.612 | Hull, S.; Keen, D. A. Pressure-induced phase transitions in AgCl, AgBr, and AgI Sample: P = 0.0 GPa, Phase I Physical Review B, 1999, 59, 750-761 |
| 9011667 | CIF | Ag Cl | F m -3 m | 5.461; 5.461; 5.461 90; 90; 90 | 162.861 | Hull, S.; Keen, D. A. Pressure-induced phase transitions in AgCl, AgBr, and AgI Sample: P = 2.5 GPa, Phase I Physical Review B, 1999, 59, 750-761 |
| 9011668 | CIF | Ag Cl | F m -3 m | 5.4138; 5.4138; 5.4138 90; 90; 90 | 158.674 | Hull, S.; Keen, D. A. Pressure-induced phase transitions in AgCl, AgBr, and AgI Sample: P = 3.9 GPa, Phase I Physical Review B, 1999, 59, 750-761 |
| 9011669 | CIF | Ag Cl | F m -3 m | 5.382; 5.382; 5.382 90; 90; 90 | 155.895 | Hull, S.; Keen, D. A. Pressure-induced phase transitions in AgCl, AgBr, and AgI Sample: P = 5.2 Gpa, Phase I Physical Review B, 1999, 59, 750-761 |
| 9011670 | CIF | Ag Cl | F m -3 m | 5.3537; 5.3537; 5.3537 90; 90; 90 | 153.448 | Hull, S.; Keen, D. A. Pressure-induced phase transitions in AgCl, AgBr, and AgI Sample: P = 6.2 Gpa, Phase I Physical Review B, 1999, 59, 750-761 |
| 9011671 | CIF | Ag Cl | F m -3 m | 5.346; 5.346; 5.346 90; 90; 90 | 152.787 | Hull, S.; Keen, D. A. Pressure-induced phase transitions in AgCl, AgBr, and AgI Sample: P = 6.6 GPa, Phase I Physical Review B, 1999, 59, 750-761 |
| 9011672 | CIF | Ag Cl | P 1 21 1 | 3.587; 3.992; 5.307 90; 98.4; 90 | 75.177 | Hull, S.; Keen, D. A. Pressure-induced phase transitions in AgCl, AgBr, and AgI Sample: P = 6.6 Gpa, Phase II Physical Review B, 1999, 59, 750-761 |
| 9011673 | CIF | Ag Cl | P 1 21 1 | 3.561; 3.994; 5.271 90; 99.12; 90 | 74.02 | Hull, S.; Keen, D. A. Pressure-induced phase transitions in AgCl, AgBr, and AgI Sample: P = 7.6 Gpa, Phase II Physical Review B, 1999, 59, 750-761 |
| 9011674 | CIF | Ag Cl | P 1 21 1 | 3.548; 3.997; 5.259 90; 99.75; 90 | 73.503 | Hull, S.; Keen, D. A. Pressure-induced phase transitions in AgCl, AgBr, and AgI Sample: P = 7.9 Gpa, Phase II Physical Review B, 1999, 59, 750-761 |
| 9011675 | CIF | Ag Cl | P 1 21 1 | 3.53; 4.011; 5.243 90; 100.69; 90 | 72.946 | Hull, S.; Keen, D. A. Pressure-induced phase transitions in AgCl, AgBr, and AgI Sample: P = 8.6 Gpa, Phase II Physical Review B, 1999, 59, 750-761 |
| 9011676 | CIF | Ag Cl | P 1 21 1 | 3.497; 4.009; 5.214 90; 102.11; 90 | 71.471 | Hull, S.; Keen, D. A. Pressure-induced phase transitions in AgCl, AgBr, and AgI Sample: P = 10.0 Gpa, Phase II Physical Review B, 1999, 59, 750-761 |
| 9011677 | CIF | Ag Cl | P 1 21 1 | 3.481; 4.016; 5.191 90; 102.87; 90 | 70.746 | Hull, S.; Keen, D. A. Pressure-induced phase transitions in AgCl, AgBr, and AgI Sample: P = 10.8 GPa, Phase II Physical Review B, 1999, 59, 750-761 |
| 9011678 | CIF | Ag Cl | C m c m | 3.399; 10.124; 4.032 90; 90; 90 | 138.747 | Hull, S.; Keen, D. A. Pressure-induced phase transitions in AgCl, AgBr, and AgI Sample: P = 10.8 Gpa, Phase III Physical Review B, 1999, 59, 750-761 |
| 9011679 | CIF | Ag Cl | C m c m | 3.369; 10.023; 4.053 90; 90; 90 | 136.86 | Hull, S.; Keen, D. A. Pressure-induced phase transitions in AgCl, AgBr, and AgI Sample: P = 12.7 GPa, Phase III Physical Review B, 1999, 59, 750-761 |
| 9011680 | CIF | Ag Cl | C m c m | 3.337; 9.907; 4.095 90; 90; 90 | 135.379 | Hull, S.; Keen, D. A. Pressure-induced phase transitions in AgCl, AgBr, and AgI Sample: P = 14.2 GPa, Phase III Physical Review B, 1999, 59, 750-761 |
| 9011681 | CIF | Ag Cl | C m c m | 3.32; 9.835; 4.108 90; 90; 90 | 134.135 | Hull, S.; Keen, D. A. Pressure-induced phase transitions in AgCl, AgBr, and AgI Sample: P = 16.1 Gpa, Phase III Physical Review B, 1999, 59, 750-761 |
| 9011682 | CIF | Ag Br | F m -3 m | 5.7721; 5.7721; 5.7721 90; 90; 90 | 192.31 | Hull, S.; Keen, D. A. Pressure-induced phase transitions in AgCl, AgBr, and AgI Sample: P = 0.0 GPa, Phase I Physical Review B, 1999, 59, 750-761 |
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