Crystallography Open Database
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COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 9011466 | CIF | Mg2 O4 Si | P b n m | 4.668; 9.852; 5.836 90; 90; 90 | 268.393 | Kudoh, Y.; Takeuchi, Y. The crystal structure of forsterite Mg2SiO4 under high pressure up to 149 kb Sample: P = 111 kbar Zeitschrift fur Kristallographie, 1985, 171, 291-302 |
| 9011467 | CIF | Mg2 O4 Si | P b n m | 4.651; 9.77; 5.744 90; 90; 90 | 261.009 | Kudoh, Y.; Takeuchi, Y. The crystal structure of forsterite Mg2SiO4 under high pressure up to 149 kb Sample: P = 149 kbar Zeitschrift fur Kristallographie, 1985, 171, 291-302 |
| 9011468 | CIF | Al2.5 Ge0.486 Nd0.029 O4.855 Pb0.083 | P 21 21 2 | 7.6648; 7.7914; 2.9213 90; 90; 90 | 174.459 | Saalfeld, H.; Klaska, K. H. A Pb/Nd-stabilized mullite of the composition Al5.03Ge0.97Pb0.15Nd0.06O9.71 Zeitschrift fur Kristallographie, 1985, 172, 129-133 |
| 9011469 | CIF | Al Li O4 Si | R -3 :H | 13.473; 13.473; 9.001 90; 90; 120 | 1414.98 | Hesse, K. F. Crystal structures of natural and synthetic alpha-eucryptite, LiAlSiO4 Zeitschrift fur Kristallographie, 1985, 172, 147-151 |
| 9011470 | CIF | Al Li O4 Si | R -3 :H | 13.471; 13.471; 8.998 90; 90; 120 | 1414.09 | Hesse, K. F. Crystal structures of natural and synthetic alpha-eucryptite, LiAlSiO4 Zeitschrift fur Kristallographie, 1985, 172, 147-151 |
| 9011471 | CIF | As2 Se3 | P 1 21/n 1 | 12.0774; 9.9037; 4.2835 90; 90.458; 90 | 512.337 | Stergiou, A. C.; Rentzeperis, P. J. The crystal structure of arsenic selenide, As2Se3 Zeitschrift fur Kristallographie, 1985, 173, 185-191 |
| 9011472 | CIF | B2 Ca O8 Si2 | P n a m | 8.037; 8.757; 7.7218 90; 90; 90 | 543.46 | Sugiyama, K.; Takeuchi, Y. Unusual thermal expansion of a B-O bond in the structure of danburite CaB2Si2O8 Locality: Toroku mine, Miyazaki Prefecture, Japan Note: AnisoB's from ICSD Sample: T = 25 C Zeitschrift fur Kristallographie, 1985, 173, 293-304 |
| 9011473 | CIF | B2 Ca O8 Si2 | P n a m | 8.046; 8.765; 7.734 90; 90; 90 | 545.426 | Sugiyama, K.; Takeuchi, Y. Unusual thermal expansion of a B-O-bond in the structure of danburite CaB2Si2O8 Locality: Toroku mine, Miyazaki Prefecture, Japan Note: AnisoB's from ICSD Sample: T = 208 C Zeitschrift fur Kristallographie, 1985, 173, 293-304 |
| 9011474 | CIF | B2 Ca O8 Si2 | P n a m | 8.061; 8.777; 7.745 90; 90; 90 | 547.97 | Sugiyama, K.; Takeuchi, Y. Unusual thermal expansion of a B-O-bond in the structure of danburite CaB2Si2O8 Locality: Toroku mine, Miyazaki Prefecture, Japan Note: AnisoB's from ICSD Sample: T = 407 C Zeitschrift fur Kristallographie, 1985, 173, 293-304 |
| 9011475 | CIF | B2 Ca O8 Si2 | P n a m | 8.078; 8.786; 7.762 90; 90; 90 | 550.895 | Sugiyama, K.; Takeuchi, Y. Unusual thermal expansion of a B-O-bond in the structure of danburite CaB2Si2O8 Locality: Toroku mine, Miyazaki Prefecture, Japan Note: AnisoB's from ICSD Sample: T = 618 C Zeitschrift fur Kristallographie, 1985, 173, 293-304 |
| 9011476 | CIF | B2 Ca O8 Si2 | P n a m | 8.092; 8.796; 7.7768 90; 90; 90 | 553.531 | Sugiyama, K.; Takeuchi, Y. Unusual thermal expansion of a B-O-bond in the structure of danburite CaB2Si2O8 Locality: Toroku mine, Miyazaki Prefecture, Japan Note: AnisoB's from ICSD Note: x(B) corrected to match reported bond lengths Sample: T = 817 C Zeitschrift fur Kristallographie, 1985, 173, 293-304 |
| 9011477 | CIF | B2 Ca O8 Si2 | P n a m | 8.101; 8.801; 7.786 90; 90; 90 | 555.118 | Sugiyama, K.; Takeuchi, Y. Unusual thermal expansion of a B-O-bond in the structure of danburite CaB2Si2O8 Locality: Toroku mine, Miyazaki Prefecture, Japan Note: AnisoB's from ICSD Sample: T = 910 C Zeitschrift fur Kristallographie, 1985, 173, 293-304 |
| 9011478 | CIF | Al2 Ca H7.909 O20.038 Si6 | P 1 c 1 | 6.7; 13.972; 10.039 90; 111.07; 90 | 876.943 | Kvick, A.; Artioli, G.; Smith, J. V. Neutron diffraction study of the zeolite yugawaralite at 13 K Sample: T = 13 K Zeitschrift fur Kristallographie, 1986, 174, 265-281 |
| 9011479 | CIF | Mg0.5 O6 Rb Si2.5 | I a -3 d | 13.53; 13.53; 13.53 90; 90; 90 | 2476.81 | Torres-Martinez L M; West, A. R. New family of silicate phases with the pollucite structure Zeitschrift fur Kristallographie, 1986, 175, 1-7 |
| 9011480 | CIF | O2 Si | P n m a | 20.108; 19.918; 13.392 90; 90; 90 | 5363.65 | Taylor, J. C.; Miller, S. A.; Bibby, D. M. A study of decomposition methods for refinement of H±ZSM5 zeolite with powder diffraction data Note: dehydrated mutinaite Zeitschrift fur Kristallographie, 1986, 176, 183-192 |
| 9011481 | CIF | H Mg2 O5 P | P 1 21/c 1 | 9.656; 12.859; 12.069 90; 108.49; 90 | 1421.21 | Raade, G.; Romming, C. The crystal structure of beta-Mg2PO4OH, a synthetic hydroxyl analogue of wagnerite Zeitschrift fur Kristallographie, 1986, 177, 15-26 |
| 9011483 | CIF | Be4 Ca6 H2 Mn O24 Si6 | P n a m | 9.793; 13.636; 13.83 90; 90; 90 | 1846.82 | Hesse, K. F.; Stumpel, G. Crystal structure of harstigite, MnCa6Be4[SiO4]2[Si2O7]2(OH)2 Zeitschrift fur Kristallographie, 1986, 177, 143-148 |
| 9011484 | CIF | H20 Mg O22 P2 U2 | P 1 21/c 1 | 6.951; 19.947; 9.896 90; 135.17; 90 | 967.336 | Miller, S. A.; Taylor, J. C. The crystal structure of saleeite, Mg[UO2PO4]2*10H2O Zeitschrift fur Kristallographie, 1986, 177, 247-253 |
| 9011486 | CIF | As4 Ca2 Cl Cu5 H18 O28 Sb | C 1 2/m 1 | 14.079; 14.203; 13.47 90; 101.05; 90 | 2643.58 | Susse, P.; Tillmann, B. The crystal structure of the new mineral richelsdorfite, Ca2Cu5Sb(Cl/(OH)6/(AsO4)4)*6H2O Zeitschrift fur Kristallographie, 1987, 179, 323-334 |
| 9011487 | CIF | As0.91 Co0.13 Fe0.87 S1.09 | C 1 1 21/d | 6.5456; 9.451; 5.6492 90; 90; 89.84 | 349.472 | Fuess, H.; Kratz, T.; Topel-Schadt J; Miehe, G. Crystal structure refinement and electron microscopy of arsenopyrite Locality: Hakansboda, Sweden Zeitschrift fur Kristallographie, 1987, 179, 335-346 |
| 9011488 | CIF | Fe1.2 Mn1.6 O4 | I 41/a m d :2 | 6.025; 6.025; 8.539 90; 90; 90 | 309.971 | Jarosch, D. Crystal structure of iwakiite Note: coordinates from ICSD, reproduce reported bond lengths Zeitschrift fur Kristallographie, 1988, 185, 605-605 |
| 9011489 | CIF | Cl2 Cu H4 O2 | P b m n | 7.4141; 8.0886; 3.7458 90; 90; 90 | 224.634 | Brownstein, S.; Han, N. F.; Gabe, E.; LePage, Y. A redetermination of the crystal structure of cupric chloride dihydrate Zeitschrift fur Kristallographie, 1989, 189, 13-15 |
| 9011490 | CIF | Fe S4 Sb2 | P n a m | 11.423; 14.174; 3.765 90; 90; 90 | 609.59 | Bente, K.; Edenharter, A. Rontgenographische strukturanalyse von MnSb2S4 und strukturverfeinerung von berthierit, FeSb2S4 Zeitschrift fur Kristallographie, 1989, 185, 31-33 |
| 9011491 | CIF | Mn S4 Sb2 | P n a m | 11.459; 14.351; 3.823 90; 90; 90 | 628.685 | Bente, K.; Edenharter, A. Rontgenographische strukturanalyse von MnSb2S4 und strukturverfeinerung von berthierit, FeSb2S4 Zeitschrift fur Kristallographie, 1989, 185, 31-33 |
| 9011492 | CIF | H4 Li Na3 O16 Si4 Ti2 | C 1 2/c 1 | 28.583; 8.6; 5.219 90; 91.03; 90 | 1282.69 | Merlino, S.; Pasero, M. The crystal structure of lintisite, Na3LiTi2[Si2O6]2O2*2H2O, a new titanosilicate from Lovozero (USSR) Zeitschrift fur Kristallographie, 1990, 193, 137-148 |
| 9011493 | CIF | O2 Si | P 31 2 1 | 4.921; 4.921; 5.4163 90; 90; 120 | 113.59 | Glinnemann, J.; King, H. E.; Schulz, H.; Hahn, T.; La Placa, S. J.; Dacol, F. Crystal structures of the low-temperature quartz-type phases of SiO2 and GeO2 at elevated pressure P = room pressure Zeitschrift fur Kristallographie, 1992, 198, 177-212 |
| 9011494 | CIF | O2 Si | P 31 2 1 | 4.775; 4.775; 5.3046 90; 90; 120 | 104.744 | Glinnemann, J.; King, H. E.; Schulz, H.; Hahn, T.; La Placa, S. J.; Dacol, F. Crystal structures of the low-temperature quartz-type phases of SiO2 and GeO2 at elevated pressure P = 4.0GPa = 40 kbar Zeitschrift fur Kristallographie, 1992, 198, 177-212 |
| 9011495 | CIF | O2 Si | P 31 2 1 | 4.6764; 4.6764; 5.2475 90; 90; 120 | 99.382 | Glinnemann, J.; King, H. E.; Schulz, H.; Hahn, T.; La Placa, S. J.; Dacol, F. Crystal structures of the low-temperature quartz-type phases of SiO2 and GeO2 at elevated pressure P = 7.2GPa = 72 kbar Zeitschrift fur Kristallographie, 1992, 198, 177-212 |
| 9011496 | CIF | O2 Si | P 31 2 1 | 4.604; 4.604; 5.207 90; 90; 120 | 95.585 | Glinnemann, J.; King, H. E.; Schulz, H.; Hahn, T.; La Placa, S. J.; Dacol, F. Crystal structures of the low-temperature quartz-type phases of SiO2 and GeO2 at elevated pressure P = 10.2GPa = 102 kbar Zeitschrift fur Kristallographie, 1992, 198, 177-212 |
| 9011497 | CIF | Be2 H9 O9 P | C 1 2/c 1 | 8.553; 12.319; 7.155 90; 97.93; 90 | 746.673 | Merlino, S.; Pasero, M. Crystal chemistry of beryllophosphates: The crystal structure of moraesite, Be2(PO4)(OH)*4H2O Locality: Humaita, Brazil Zeitschrift fur Kristallographie, 1992, 201, 253-262 |
| 9011498 | CIF | Be4 Ca3.94 Ce0.12 F3.46 La0.06 Na3.76 Nd0.09 O24.54 Pr0.03 Si8 | P 1 | 7.417; 7.398; 9.986 90; 90; 90 | 547.941 | Cannillo, E.; Giuseppetti, G.; Mazzi, F.; Tazzoli, V. The crystal structure of a rare earth bearing leucophanite: (Ca,RE)CaNa2Be2Si4O12(F,O)2 Zeitschrift fur Kristallographie, 1992, 202, 71-79 |
| 9011499 | CIF | Al2 O12 S3 | R -3 :H | 8.0246; 8.0246; 21.357 90; 90; 120 | 1191.02 | Dahmen, T.; Gruehn, R. Beitrage zum thermischen verhalten von sulfaten. IX. Einkristallstrukturverfeinerung der metall(III)-sulfate Cr2(SO4)3 und Al2(SO4)3 Locality: synthetic Zeitschrift fur Kristallographie, 1993, 204, 57-65 |
| 9011500 | CIF | Cr2 O12 S3 | R -3 :H | 8.1245; 8.1245; 21.944 90; 90; 120 | 1254.41 | Dahmen, T.; Gruehn, R. Beitraege zum thermischen verhalten von sulfaten. IX. Einkristallstrukturverfeinerung der metall(III)-sulfate Cr2(SO4)3 und Al2(SO4)3 Zeitschrift fur Kristallographie, 1993, 204, 57-65 |
| 9011505 | CIF | As4.782 Pb S9 Sb0.218 Tl | P b c a | 10.786; 35.389; 8.141 90; 90; 90 | 3107.47 | Matsushita, Y.; Takeuchi, Y. Refinement of the crystal structure of hutchinsonite, TlPbAs5S9 Zeitschrift fur Kristallographie, 1994, 209, 475-478 |
| 9011506 | CIF | Fe0.507 Ni0.493 | P 1 m 1 | 3.581; 3.582; 3.587 90; 90.04; 90 | 46.011 | Tagai, T.; Takeda, H. Superstructure of tetrataenite from the Saint Severin meteorite Zeitschrift fur Kristallographie, 1995, 210, 14-18 |
| 9011507 | CIF | Cu1.04 Mn0.96 O2 | C 1 2/m 1 | 5.578; 2.881; 5.886 90; 104; 90 | 91.78 | Topfer, J.; Trari, M.; Gravereau, P.; Chaminade, J. P.; Doumerc, J. P. Crystal growth and reinvestigation of the crystal structure of crednerite, CuMnO2 Locality: synthetic Zeitschrift fur Kristallographie, 1995, 210, 184-187 |
| 9011508 | CIF | Cu2 H14 O18 S2 Zn3 | P -1 | 5.4143; 6.336; 10.47 94.32; 90.06; 90.27 | 358.149 | Adiwidjaja, G.; Friese, K.; Klaska, K. H.; Schluter, J. The crystal structure of christelite Zn3Cu2(SO4)2(OH)6*4(H2O) Note: anisoU's from ICSD Zeitschrift fur Kristallographie, 1996, 211, 518-521 |
| 9011509 | CIF | Cu0.5 H8 O10 P U | P 4/n m m :2 | 6.95; 6.95; 8.638 90; 90; 90 | 417.237 | Calos, N. J.; Kennard, C. H. L. Crystal structure of copper bis(uranyl phosphate) octahydrate (metatobernite), Cu(UO2PO4)2*8(H2O) Locality: Sonora, Mexico Zeitschrift fur Kristallographie, 1996, 211, 701-702 |
| 9011510 | CIF | Bi4 O12 Si3 | I -4 3 d | 10.2867; 10.2867; 10.2867 90; 90; 90 | 1088.5 | Liu, H.; Kuo, C. Crystal structure of bismuth(III) silicate, Bi4(SiO4)3 Zeitschrift fur Kristallographie, 1997, 212, 48-48 |
| 9011511 | CIF | Cl H18 Na O16 S Zn4 | P -3 | 8.3556; 8.3556; 13.025 90; 90; 120 | 787.524 | Adiwidjaja, G.; Friese, K.; Klaska, K. H.; Schluter, J. The crystal structure of gordaite NaZn4(SO4)(OH)6Cl*6H2O Zeitschrift fur Kristallographie, 1997, 212, 704-707 |
| 9011512 | CIF | Al H3 O3 | P -1 | 4.9997; 5.1681; 4.9832 97.444; 118.688; 104.661 | 104.386 | Clark, G. R.; Rodgers, K. A.; Henderson, G. S. The crystal chemistry of doyleite, Al(OH)~3~ Zeitschrift für Kristallographie, 1998, 213, 96-100 |
| 9011513 | CIF | Mg Na O4 P | P 21 21 21 | 8.828; 6.821; 15.25 90; 90; 90 | 918.291 | Alkemper, J.; Fuess, H. The crystal structures of NaMgPO~4~, Na~2~CaMg(PO~4~)~2~ and Na~18~Ca~13~Mg~5~(PO~4~)~18~: new examples for glaserite related structures Zeitschrift für Kristallographie, 1998, 213, 282-287 |
| 9011514 | CIF | Ca Mg Na2 O8 P2 | P 1 21/c 1 | 9.12; 5.198; 13.37 90; 90.78; 90 | 633.756 | Alkemper, J.; Fuess, H. The crystal structures of NaMgPO~4~, Na~2~CaMg(PO~4~)~2~ and Na~18~Ca~13~Mg~5~(PO~4~)~18~: new examples for glaserite related structures Note: known as the alpha polymorph of Na~2~CaMg(PO~4~)~2~ Zeitschrift für Kristallographie, 1998, 213, 282-287 |
| 9011515 | CIF | Ca Mg Na2 O8 P2 | P -3 m 1 | 5.309; 5.309; 7.237 90; 90; 120 | 176.65 | Alkemper, J.; Fuess, H. The crystal structures of NaMgPO~4~, Na~2~CaMg(PO~4~)~2~ and Na~18~Ca~13~Mg~5~(PO~4~)~18~: new examples for glaserite related structures Note: known as the beta polymorph of Na~2~CaMg(PO~4~)~2~ Zeitschrift für Kristallographie, 1998, 213, 282-287 |
| 9011516 | CIF | Ca13 Mg5 Na18 O72 P18 | R -3 m :H | 15.811; 15.811; 21.499 90; 90; 120 | 4654.44 | Alkemper, J.; Fuess, H. The crystal structures of NaMgPO~4~, Na~2~CaMg(PO~4~)~2~ and Na~18~Ca~13~Mg~5~(PO~4~)~18~: new examples for glaserite related structures Zeitschrift für Kristallographie, 1998, 213, 282-287 |
| 9011517 | CIF | Cl6 Cu9 O14 Se4 | I 1 2/m 1 | 14.17; 6.262; 12.999 90; 113.05; 90 | 1061.35 | Krivovichev, S. V.; Filatov, S. K.; Semenova, T. F.; Rozhdestvenskaya, I. V. Crystal chemistry of inorganic compounds based on chains of oxocentered tetrahedra I. Crystal structure of chloromenite, Cu~9~O~2~(SeO~3~)~4~Cl~6~ Zeitschrift für Kristallographie, 1998, 213, 645-649 |
| 9011518 | CIF | Cl2 Cu5 O8 Se2 | P 1 21/c 1 | 6.03; 13.744; 5.562 90; 95.75; 90 | 458.639 | Krivovichev, S. V.; Shuvalov, R. R.; Semenova, T. F.; Filatov, S. K. Crystal chemistry of inorganic compounds based on chains of oxocentered tetrahedra. III. Crystal structure of georgbokiite, Cu5O2(SeO3)2Cl2 Zeitschrift fur Kristallographie, 1999, 214, 135-138 |
| 9011519 | CIF | Al2 H18 Mn O18 P2 | P -1 | 10.205; 10.504; 7.01 90.38; 110.1; 71.82 | 666.159 | Adiwidjaja, G.; Friese, K.; Klaska, K. H.; Schluter, J. The crystal structure of kastningite (Mn,Fe,Mg)(H2O)4[Al2(OH)2(H2O)2(PO4)2]*2H2O - a new hydroxyl aquated orthophosphate hydrate mineral Locality: Waidhaus, Bavaria, Germany Note: changed sign of Oh1(y) Zeitschrift fur Kristallographie, 1999, 214, 465-468 |
| 9011520 | CIF | Au Bi Pb2 S3 Te2 | P m m n :2 | 4.108; 12.308; 9.331 90; 90; 90 | 471.787 | Effenberger, H.; Culetto, F. J.; Topa, D.; Paar, W. H. The crystal structure of synthetic buckhornite, [Pb2BiS3][AuTe2] Zeitschrift fur Kristallographie, 2000, 215, 10-16 |
| 9011521 | CIF | As2 Fe2 H2 O10 Zn | P 1 21/n 1 | 6.631; 7.611; 7.377 90; 91.8; 90 | 372.123 | Adiwidjaja, G.; Friese, K.; Klaska, K. H.; Moore, P. B.; Schluter, J. The crystal structure of the new mineral wilhelmkleinite ZnFe3+2(OH)2(AsO4)2 Zeitschrift fur Kristallographie, 2000, 215, 96-101 |
| 9011522 | CIF | H4 Na3 O16 Si4 Ti2 Zn0.5 | P c c n | 29.029; 8.595; 5.209 90; 90; 90 | 1299.67 | Merlino, S.; Pasero, M.; Ferro, O. The crystal structure of kukisvumite, Na6ZnTi4(Si2O6)4O4*4H2O Locality: Kukisvumtschorr deposit, Khibiny alkaline massif, Kola peninsula, Russia Zeitschrift fur Kristallographie, 2000, 215, 352-356 |
| 9011523 | CIF | Ca4 Fe0.41 H2 O28 Sc1.52 Si8 Sn2.07 | C 1 | 10.028; 8.408; 13.339 90.01; 109.1; 90 | 1062.77 | Ferraris, G.; Gula, A.; Ivaldi, G.; Nespolo, M.; Raade, G. Crystal structure of kristiansenite: a case of class IIB twinning by metric merohedry Locality: amazonite pegmatite, Heftetjern, Tordal, Telemark, Norway Zeitschrift fur Kristallographie, 2001, 216, 442-448 |
| 9011524 | CIF | Ag0.474 As4.522 Pb2.739 S10 Sb0.265 | P 1 21/c 1 | 8.496; 7.969; 25.122 90; 100.704; 90 | 1671.28 | Berlepsch, P.; Armbruster, T.; Topa, D. Structural and chemical variations in rathite, Pb8Pb4-x(Tl2As2)x(Ag2As2)As16S40: modulations of a parent structure Locality: Valais, Switzerland Zeitschrift fur Kristallographie, 2002, 217, 581-590 |
| 9011525 | CIF | As2 Cu H12.656 O24 U2 | I 4/m m m | 7.1751; 7.1751; 20.8728 90; 90; 90 | 1074.57 | Hennig, C.; Reck, G.; Reich, T.; Robberg, A.; Kraus, W.; Sieler, J. EXAFS and XRD investigations of zeunerite and meta-zeunerite Zeitschrift fur Kristallographie, 2003, 218, 37-45 |
| 9011526 | CIF | As Cu0.5 H4 O10 U | P 4/n c c :2 | 7.1065; 7.1065; 17.4195 90; 90; 90 | 879.726 | Hennig, C.; Reck, G.; Reich, T.; Robberg, A.; Kraus, W.; Sieler, J. EXAFS and XRD investigations of zeunerite and meta-zeunerite Sample: Ordered Zeitschrift fur Kristallographie, 2003, 218, 37-45 |
| 9011527 | CIF | As Cu0.5 H8 O10 U | P 4/n m m :2 | 7.1065; 7.1065; 8.7095 90; 90; 90 | 439.85 | Hennig, C.; Reck, G.; Reich, T.; Robberg, A.; Kraus, W.; Sieler, J. EXAFS and XRD investigations of zeunerite and meta-zeunerite Sample: Disordered Zeitschrift fur Kristallographie, 2003, 218, 37-45 |
| 9011528 | CIF | Cr2 H4 K2 Mg O10 | P -1 | 5.674; 6.462; 7.517 110.38; 95.24; 109.86 | 236.026 | Fleck, M.; Kolitsch, U. Natural and synthetic compounds with krohnkite-type chains. An update Zeitschrift fur Kristallographie, 2003, 218, 553-567 |
| 9011529 | CIF | H4 K2 Mg Mo2 O10 | P -1 | 5.884; 6.491; 7.7 111.67; 96.59; 108.62 | 249.795 | Fleck, M.; Kolitsch, U. Natural and synthetic compounds with krohnkite-type chains. An update Zeitschrift fur Kristallographie, 2003, 218, 553-567 |
| 9011530 | CIF | H4 K2 Mn O10 Se2 | P -1 | 5.674; 6.608; 7.523 110.31; 95.69; 108.35 | 244.099 | Fleck, M.; Kolitsch, U. Natural and synthetic compounds with krohnkite-type chains. An update Zeitschrift fur Kristallographie, 2003, 218, 553-567 |
| 9011531 | CIF | Ca2 Fe0.89 H4 Mg0.11 O10 P2 | P -1 | 5.48; 5.759; 6.569 90.18; 102.62; 108.45 | 191.32 | Fleck, M.; Kolitsch, U. Natural and synthetic compounds with krohnkite-type chains. An update Zeitschrift fur Kristallographie, 2003, 218, 553-567 |
| 9011532 | CIF | Cr4 H4 K2 O16 Zn | P -1 | 6.794; 7.735; 7.834 88.97; 80.9; 64.57 | 366.545 | Fleck, M.; Kolitsch, U. Natural and synthetic compounds with krohnkite-type chains. An update Zeitschrift fur Kristallographie, 2003, 218, 553-567 |
| 9011533 | CIF | Ca O3 Si | P -1 | 6.596; 9.223; 6.554 83.75; 77.28; 70.07 | 365.385 | Joswig, W.; Paulus, E. F.; Winkler, B.; Milman, V. The crystal structure of CaSiO3-walstromite, a special isomorph of wollastonite-II Zeitschrift fur Kristallographie, 2003, 218, 811-818 |
| 9011535 | CIF | C2.784 H9.112 F2 Li0.618 Mg2.382 N0.696 O10 Si4 | C 1 2/m 1 | 5.2735; 9.1165; 13.561 90; 97.69; 90 | 646.093 | Seidl, W.; Breu, J. Single crystal structure refinement of tetramethylammonium-hectorite Note: isostructural with hectorite Note: anisoU's and H data from ICSD Zeitschrift fur Kristallographie, 2005, 220, 169-176 |
| 9011536 | CIF | C2 Ba Ca2 F2 O6 | C m c m | 12.501; 5.846; 9.443 90; 90; 90 | 690.102 | Zubkova, N. V.; Pushcharovsky, D. Y.; Pekov, I. V.; Rabadanov, M. K. The crystal structure of podlesnoite, BaCa2(CO3)2F2 Zeitschrift fur Kristallographie, 2007, 222, 474-476 |
| 9011544 | CIF | Br H O Zn | P c a b | 5.903; 6.7; 11.86 90; 90; 90 | 469.064 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Crystal Structures, 1963, 1, 282-287 |
| 9011550 | CIF | Cs | F m -3 m | 5.984; 5.984; 5.984 90; 90; 90 | 214.277 | Hall, H. T.; Merrill, L.; Barnett, J. D. High-pressure polymorphism in cesium Sample: at P = 4.1 GPa & T = 27 C Note: known as Cesium-II Note: stable between 2.37 GPa & 4.22 GPa Science, 1964, 146, 1297-1299 |
| 9011551 | CIF | Cs | F m -3 m | 5.8; 5.8; 5.8 90; 90; 90 | 195.112 | Hall, H. T.; Merrill, L.; Barnett, J. D. High-pressure polymorphism in cesium Sample: at P = 4.25 GPa & T = 27 C Note: known as Cesium-III Note: stable between 4.22 GPa & 4.27 GPa Science, 1964, 146, 1297-1299 |
| 9011552 | CIF | Al4 B12 Be4 Cs O28 | P -4 3 m | 7.319; 7.319; 7.319 90; 90; 90 | 392.062 | Buerger, M. J.; Taxer, K. Rhodizite. Structure and composition Science, 1966, 152, 500-502 |
| 9011553 | CIF | Cd Ge O3 | I 41/a | 12.406; 12.406; 12.256 90; 90; 90 | 1886.31 | Prewitt, C. T.; Sleight, A. W. Garnet-like structures of high-pressure cadmium germanate and calcium germanate Note: changed O2(y) to -.0500 to match reported bond distances Science, 1969, 163, 386-387 |
| 9011554 | CIF | Fe2 Na O15 Si6 | C m c e | 14.31; 17.28; 10.11 90; 90; 90 | 2499.97 | Merlino, S. Tuhualite crystal structure Locality: Mayor Island, New Zealand Note: Position of H2O not determined in paper Science, 1969, 166, 1399-1401 |
| 9011555 | CIF | B15 H1.6 N3 O32 | C 1 2/c 1 | 25.27; 9.65; 11.56 90; 94.28; 90 | 2811.11 | Merlino, S.; Sartori, F. Ammonioborite: New borate polyion and its structure Science, 1971, 171, 377-379 |
| 9011556 | CIF | Li | I m -3 m | 3.285; 3.285; 3.285 90; 90; 90 | 35.449 | Olinger, B.; Shaner, J. W. Lithium, compression and high-pressure structure Sample: at P = 3.3 GPa, T = 296 K Note: film # 2-3 Science, 1983, 219, 1071-1072 |
| 9011557 | CIF | Li | I m -3 m | 3.272; 3.272; 3.272 90; 90; 90 | 35.03 | Olinger, B.; Shaner, J. W. Lithium, compression and high-pressure structure Sample: at P = 3.5 GPa, T = 296 K Note: film # 4-4 Science, 1983, 219, 1071-1072 |
| 9011558 | CIF | Li | I m -3 m | 3.216; 3.216; 3.216 90; 90; 90 | 33.262 | Olinger, B.; Shaner, J. W. Lithium, compression and high-pressure structure Sample: at P = 4.7 GPa, T = 296 K Note: film # 4-5 Science, 1983, 219, 1071-1072 |
| 9011559 | CIF | Li | I m -3 m | 3.217; 3.217; 3.217 90; 90; 90 | 33.293 | Olinger, B.; Shaner, J. W. Lithium, compression and high-pressure structure Sample: at P = 4.7 GPa, T = 296 K Note: film # 2-4 Science, 1983, 219, 1071-1072 |
| 9011560 | CIF | Li | I m -3 m | 3.161; 3.161; 3.161 90; 90; 90 | 31.584 | Olinger, B.; Shaner, J. W. Lithium, compression and high-pressure structure Sample: at P = 6.6 GPa, T = 296 K Note: film # 2-5 Science, 1983, 219, 1071-1072 |
| 9011561 | CIF | Li | F m -3 m | 3.9; 3.9; 3.9 90; 90; 90 | 59.319 | Olinger, B.; Shaner, J. W. Lithium, compression and high-pressure structure Sample: at P = 8.0 GPa, T = 296 K Note: film # 4-7 Science, 1983, 219, 1071-1072 |
| 9011562 | CIF | Li | F m -3 m | 3.855; 3.855; 3.855 90; 90; 90 | 57.289 | Olinger, B.; Shaner, J. W. Lithium, compression and high-pressure structure Sample: at P = 9.6 GPa, T = 296 K Note: film # 2-8 Science, 1983, 219, 1071-1072 |
| 9011563 | CIF | Li | F m -3 m | 3.843; 3.843; 3.843 90; 90; 90 | 56.756 | Olinger, B.; Shaner, J. W. Lithium, compression and high-pressure structure Sample: at P = 9.8 GPa, T = 296 K Note: film # 4-9 Science, 1983, 219, 1071-1072 |
| 9011564 | CIF | Li | F m -3 m | 3.832; 3.832; 3.832 90; 90; 90 | 56.27 | Olinger, B.; Shaner, J. W. Lithium, compression and high-pressure structure Sample: at P = 9.9 GPa, T = 296 K Note: film # 4-10 Science, 1983, 219, 1071-1072 |
| 9011565 | CIF | Li | F m -3 m | 3.828; 3.828; 3.828 90; 90; 90 | 56.094 | Olinger, B.; Shaner, J. W. Lithium, compression and high-pressure structure Sample: at P = 10.1 GPa, T = 296 K Note: film # 4-11 Science, 1983, 219, 1071-1072 |
| 9011566 | CIF | H | P 63/m m c | 2.659; 2.659; 4.334 90; 90; 120 | 26.537 | Mao, H. K.; Jephcoat, A. P.; Hemley, R. J.; Finger, L. W.; Zha, C. S.; Hazen, R. M.; Cox, D. E. Synchrotron X-ray diffraction measurements of single-crystal hydrogen to 26.5 Gigapascals Sample: at P = 5.40 GPa, T = 300 K Science, 1988, 239, 1131-1133 |
| 9011567 | CIF | H | P 63/m m c | 2.5058; 2.5058; 4.074 90; 90; 120 | 22.154 | Mao, H. K.; Jephcoat, A. P.; Hemley, R. J.; Finger, L. W.; Zha, C. S.; Hazen, R. M.; Cox, D. E. Synchrotron X-ray diffraction measurements of single-crystal hydrogen to 26.5 Gigapascals Sample: at P = 10.1 GPa, T = 300 K Science, 1988, 239, 1131-1133 |
| 9011568 | CIF | H | P 63/m m c | 2.393; 2.393; 3.885 90; 90; 120 | 19.267 | Mao, H. K.; Jephcoat, A. P.; Hemley, R. J.; Finger, L. W.; Zha, C. S.; Hazen, R. M.; Cox, D. E. Synchrotron X-ray diffraction measurements of single-crystal hydrogen to 26.5 Gigapascals Sample: at P = 15.0 GPa, T = 300 K Science, 1988, 239, 1131-1133 |
| 9011569 | CIF | H | P 63/m m c | 2.308; 2.308; 3.703 90; 90; 120 | 17.083 | Mao, H. K.; Jephcoat, A. P.; Hemley, R. J.; Finger, L. W.; Zha, C. S.; Hazen, R. M.; Cox, D. E. Synchrotron X-ray diffraction measurements of single-crystal hydrogen to 26.5 Gigapascals Sample: at P = 21.4 GPa, T = 300 K Science, 1988, 239, 1131-1133 |
| 9011570 | CIF | H | P 63/m m c | 2.259; 2.259; 3.609 90; 90; 120 | 15.95 | Mao, H. K.; Jephcoat, A. P.; Hemley, R. J.; Finger, L. W.; Zha, C. S.; Hazen, R. M.; Cox, D. E. Synchrotron X-ray diffraction measurements of single-crystal hydrogen to 26.5 Gigapascals Sample: at P = 26.5 GPa, T = 300 K Science, 1988, 239, 1131-1133 |
| 9011571 | CIF | Fe4.93 H O8 | P 63 m c | 5.928; 5.928; 9.126 90; 90; 120 | 277.733 | Michel, F. M.; Ehm, L.; Antao, S. M.; Lee, P. L.; Chupas, P. J.; Liu, G.; Strongin, D. R.; Schoonen, M. A. A.; Phillips, B. L.; Parise, J. B. The structure of ferrihydrite, a nanocrystalline material Sample: Fhyd6 Science, 2007, 316, 1726-1729 |
| 9011572 | CIF | Fe4.87 H O8 | P 63 m c | 5.953; 5.953; 9.096 90; 90; 120 | 279.16 | Michel, F. M.; Ehm, L.; Antao, S. M.; Lee, P. L.; Chupas, P. J.; Liu, G.; Strongin, D. R.; Schoonen, M. A. A.; Phillips, B. L.; Parise, J. B. The structure of ferrihydrite, a nanocrystalline material Sample: Fhyd3 Science, 2007, 316, 1726-1729 |
| 9011573 | CIF | Fe4.75 H O8 | P 63 m c | 5.958; 5.958; 8.965 90; 90; 120 | 275.602 | Michel, F. M.; Ehm, L.; Antao, S. M.; Lee, P. L.; Chupas, P. J.; Liu, G.; Strongin, D. R.; Schoonen, M. A. A.; Phillips, B. L.; Parise, J. B. The structure of ferrihydrite, a nanocrystalline material Sample: Fhyd2 Science, 2007, 316, 1726-1729 |
| 9011574 | CIF | Cr | P 63/m m c | 2.714; 2.714; 4.41 90; 90; 120 | 28.131 | Bradley, A. J.; Ollard, E. F. Allotropy of chromium Nature, 1926, 117, 122-122 |
| 9011575 | CIF | C | F d -3 m :1 | 3.56679; 3.56679; 3.56679 90; 90; 90 | 45.377 | Riley, D. P. Lattice constant of diamond and the C-C single bond Sample: at T = 18 C Nature, 1944, 153, 587-588 |
| 9011576 | CIF | Al Ca3 H34 O24.5 S1.5 | P 63/m c m | 11.23; 11.23; 10.72 90; 90; 120 | 1170.81 | Moore, A.; Taylor, H. F. W. Crystal structure of ettringite Nature, 1968, 218, 1048-1049 |
| 9011577 | CIF | C | P 63/m m c | 2.464; 2.464; 6.711 90; 90; 120 | 35.286 | Trucano, P.; Chen, R. Structure of graphite by neutron diffraction Note: natural crystals Nature, 1975, 258, 136-137 |
| 9011579 | CIF | Mg Na2 O12 Si5 | P 1 2/n 1 | 9.418; 8.647; 5.274 90; 108.13; 90 | 408.178 | Angel, R. J.; Gasparik, T.; Ross, N. L.; Finger, L. W.; Prewitt, C. T.; Hazen, R. M. A silica-rich sodium pyroxene phase with six-coordinated silicon Nature, 1988, 335, 156-158 |
| 9011580 | CIF | C60 | P a -3 | 14.04078; 14.04078; 14.04078 90; 90; 90 | 2768.05 | David, W. I. F.; Ibberson, R. M.; Matthewman, J. C.; Prassides, K.; Dennis, T. J. S.; Hare, J. P.; Kroto, H. W.; Taylor, R.; Walton, D. R. M. Crystal structure and bonding of ordered C60 Sample: at T = 5 K Note: phase: carbon C60 Nature, 1991, 353, 147-149 |
| 9011581 | CIF | Mg O3 Si | C 1 2/c 1 | 9.201; 8.621; 4.908 90; 101.5; 90 | 381.496 | Angel, R. J.; Chopelas, A.; Ross, N. L. Stability of high-density clinoenstatite at upper-mantle pressures Sample: P = 7.93 GPa Nature, 1992, 358, 322-324 |
| 9011582 | CIF | Au2 Te3 | P 1 | 12.11; 13.44; 10.8 104.38; 97.5; 107.93 | 1578.64 | Bachechi, F. Crystal structure of montbrayite Locality: Robb-Montbray, Quebec Nature Physical Science, 1971, 231, 67-68 |
| 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 |
| 9011683 | CIF | Ag Br | F m -3 m | 5.7103; 5.7103; 5.7103 90; 90; 90 | 186.199 | Hull, S.; Keen, D. A. Pressure-induced phase transitions in AgCl, AgBr, and AgI Sample: P = 1.5 GPa, Phase I Physical Review B, 1999, 59, 750-761 |
| 9011684 | CIF | Ag Br | F m -3 m | 5.6344; 5.6344; 5.6344 90; 90; 90 | 178.872 | 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 |
| 9011685 | CIF | Ag Br | F m -3 m | 5.5673; 5.5673; 5.5673 90; 90; 90 | 172.558 | 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 |
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