Crystallography Open Database
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COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 9012646 | CIF | C5 Ba0.501 Ca1.437 Ce0.438 La0.243 Na2.667 Nd0.099 O15 Sr0.549 | P 63 m c | 10.4974; 10.4974; 6.4309 90; 90; 120 | 613.714 | Belovitskaya, Y. V.; Pekov, I. V.; Gobechiya, E. R.; Kabalov, Y. K.; Subbotin, V. V. Crystal structure of calcioburbankite and the characteristic features of the burbankite structure type Crystallography Reports, 2001, 46, 927-931 |
| 9012647 | CIF | Ca0.35 Fe0.14 H10.8 Hf0.03 K0.09 Mn0.08 Na2.39 O18.9 Si6 Ti0.03 Zr0.8 | R 3 :H | 10.18; 10.18; 13.13 90; 90; 120 | 1178.4 | Yamnova, N. A.; Egorov-Tismenko Y K; Pekov, I. V. Refined crystal structure of lovozerite Na2CaZr[Si6O12(OH,O)6]*H2O Crystallography Reports, 2001, 46, 937-941 |
| 9012648 | CIF | C5 Ba1.08 Ca0.87 Ce0.48 La0.18 Na2.58 Nd0.15 O15 Pr0.03 Sr0.63 | P 63 m c | 10.579; 10.579; 6.5446 90; 90; 120 | 634.312 | Belovitskaya, Y. V.; Pekov, I. V.; Gobechiya, E. R.; Kabalov, Y. K.; Schneider, J. Determination of the crystal structure of khanneshite by the Rietveld method Crystallography Reports, 2002, 47, 39-42 |
| 9012649 | CIF | C H3 Ba1.27 Ca0.21 F Fe0.675 K0.2 Mn0.375 Na1.95 Nb0.05 O13 Si2 Sr0.32 Ti0.95 | P -1 | 5.399; 7.016; 16.254 102.44; 93.18; 90.1 | 600.251 | Zhou, H.; Rastsvetaeva, R. K.; Khomyakov, A. P.; Ma, Z.; Shi, N. Crystal structure of new micalike titanosilicate - bussenite, Na2Ba2Fe2+[TiSi2O7][CO3]O(OH)(H2O)F Crystallography Reports, 2002, 47, 43-46 |
| 9012650 | CIF | Ca0.55 F2 Mn0.85 Na3.2 O16 Si4 Ti1.15 Zr1.85 | P 1 2/c 1 | 5.627; 7.134; 18.59 90; 102.68; 90 | 728.058 | Pushcharovskii D Yu; Pasero, M.; Merlino, S.; Vladykin, N. V.; Zubkova, N. V.; Gobechiya, E. R. Crystal structure of zirconium-rich seidozerite Crystallography Reports, 2002, 47, 196-200 |
| 9012651 | CIF | C2 H2.83 Ba0.01 Ca0.02 Ce0.52 F0.13 La0.28 Nd0.11 O7.73 Pr0.04 Sm0.01 Sr0.97 | P m c 21 | 5.0634; 8.5898; 7.2781 90; 90; 90 | 316.551 | Belovitskaya, Y. V.; Pekov, I. V.; Gobechiya, E. R.; Yamnova, N. A.; Kabalov, Y. K.; Chukanov, N. V.; Schneider, J. Crystal structures of two ancylite modifications Locality: Lovchorrite Mine, Hackman Velley, Khibiny massif, Kola Peninsula, Russia Sample: Specimen 52 Crystallography Reports, 2002, 47, 223-228 |
| 9012652 | CIF | C H2.225 Ba0.005 Ca0.025 Ce0.31 F0.075 La0.2 Nd0.045 O3.925 Pr0.015 Sr0.4 | P m c n | 5.0577; 8.5665; 7.3151 90; 90; 90 | 316.94 | Belovitskaya, Y. V.; Pekov, I. V.; Gobechiya, E. R.; Yamnova, N. A.; Kabalov, Y. K.; Chukanov, N. V.; Schneider, J. Crystal structures of two ancylite modifications Sample: Specimen 54 Crystallography Reports, 2002, 47, 223-228 |
| 9012653 | CIF | Al3 Ca0.828 Cl0.048 Na3.172 O13.76 S1.022 Si3 | P 2 3 | 9.077; 9.077; 9.077 90; 90; 90 | 747.872 | Rastsvetaeva, R. K.; Bolotina, N. B.; Sapozhnikov, A. N.; Kashaev, A. A.; Schoenleber, A.; Chapuis, G. Average structure of cubic lazurite with a three-dimensional incommensurate modulation Crystallography Reports, 2002, 47, 404-407 |
| 9012654 | CIF | Ca0.333 H4 Na0.333 O11 Si3 Zr | R 3 2 :H | 10.498; 10.498; 7.975 90; 90; 120 | 761.157 | Pushcharovsky, D. Y.; Pekov, I. V.; Pasero, M.; Gobechiya, E. R.; Merlino, S.; Zubkova, N. V. Crystal structure of cation-deficient calciohilairite and possible mechanisms of decationization in mixed-framework minerals Locality: Lovozero massif, Kola Peninsula, Russia Crystallography Reports, 2002, 47, 748-752 |
| 9012655 | CIF | Al0.84 Ca0.82 F0.29 Fe2.1 H1.47 K0.13 Mg2.7 Mn0.02 Na2.05 O23.71 Si7.16 Ti0.17 | C 1 2/m 1 | 9.875; 18.01; 5.309 90; 104.39; 90 | 914.576 | Pushcharovsky, D. Y.; Lebedeva, Y. S.; Pekov, I. V.; Ferraris, G.; Novakova, A. A.; Ivaldi, G. Crystal structure of magnesioferrikatophorite Locality: Turiy Cape, Kola Peninsula, Russia Crystallography Reports, 2003, 48, 16-23 |
| 9012657 | CIF | Ba3.3 Ca2.4 F8 Fe8 H4 K0.7 Mn7.4 Na2.2 Nb0.8 O68 Si16 Ti6.4 Zr0.8 | C 1 2 1 | 10.723; 13.826; 20.791 90; 95; 90 | 3070.67 | Rozenberg, K. A.; Rastsvetaeva, R. K.; Verin, I. A. Crystal structure of surkhobite - new mineral from the family of titanosilicate micas Crystallography Reports, 2003, 48, 384-389 |
| 9012658 | CIF | Ca3.3 Ce0.33 Cl0.74 Fe2.1 H18.453 K0.3 La0.132 Mn1.398 Na9.627 Nb0.1 Nd0.036 O79.661 Si24.3 Sr0.504 Ti0.1 Zr3.4 | R 3 m :H | 14.167; 14.167; 30.081 90; 90; 120 | 5228.52 | Rastsvetaeva, R. K.; Chukanov, N. V. Ikranite: composition and structure of a new mineral of the eudialyte group Crystallography Reports, 2003, 48, 717-720 |
| 9012659 | CIF | As4 Cl Cu5 H10 Na O21 Pb | P 1 21/n 1 | 10.023; 19.55; 10.023 90; 90.02; 90 | 1964 | Zubkova, N. V.; Pushcharovsky, D. Y.; Sarp, H.; Teat, S. J.; MacLean, E. J. Crystal structure of zdenekite NaPbCu5(AsO4)4Cl*5H2O Crystallography Reports, 2003, 48, 939-943 |
| 9012660 | CIF | Ba0.05 Ca0.4 H6.136 K0.4 Na1.4 Nb1.6 O35.3 Si8 Sr0.8 Ti2.4 | C 1 2/m 1 | 14.596; 14.249; 15.852 90; 117.27; 90 | 2930.45 | Organova, N. I.; Krivovichev, S. V.; Shlyukova, Z. V.; Zadov, A. E.; Rozhdestvenskaya, I. V.; Ivanova, T. I. Structure of new mineral paratsepinite-Na and its place in the labuntsovite group Crystallography Reports, 2004, 49, 946-952 |
| 9012661 | CIF | Ba1.9 Ce2 F0.7 Fe0.16 H2.3 K0.05 Mg0.05 Mn0.52 Na0.95 O27.3 Si8 Sr0.1 Ti2 Zn0.27 | A m a 2 | 22.301; 10.514; 9.669 90; 90; 90 | 2267.12 | Zubkova, N. V.; Pushcharovsky, D. Y.; Giester, G.; Tillmanns, E.; Pekov, I. V.; Krotova, O. D. Crystal structure of byelorussite-(Ce) NaMnBa2Ce2(TiO)2[Si4O12]2(F,OH)*H2O Crystallography Reports, 2004, 49, 964-968 |
| 9012662 | CIF | C2 H8 Al0.12 B3.51 Ca6 Cl0.408 Fe0.351 Mg1.649 O18.888 Si0.49 | F d -3 m :2 | 14.679; 14.679; 14.679 90; 90; 90 | 3162.93 | Yakubovich, O. V.; Steele, I. M.; Gavrilenko, P. G.; Urusov, V. S. Crystal structure of sakhaite from the Solongo deposit in connection with the crystal chemical interpretation of the sakhaite-harkerite mineral series Crystallography Reports, 2005, 50, 226-234 |
| 9012663 | CIF | C H6.82 Al0.08 Ca9.348 Ce0.102 Cl0.29 Fe2.19 K0.6 Mn0.3 Na10.44 Nb0.57 O78.53 Si24.66 Zr3 | R 3 m :H | 14.231; 14.231; 29.984 90; 90; 120 | 5258.85 | Rozenberg, K. A.; Rastsvetaeva, R. K.; Chukanov, N. V.; Verin, I. A. Crystal structure of golyshevite Crystallography Reports, 2005, 50, 539-543 |
| 9012664 | CIF | Al3.996 Ca0.84 H75 K1.333 Na1.02 O36.168 Si8.004 | R -3 m :H | 13.831; 13.831; 15.023 90; 90; 120 | 2488.83 | Yakubovich, O. V.; Massa, W.; Gavrilenko, P. G.; Pekov, I. V. Crystal structure of chabazite K Sample: T = 193 K Crystallography Reports, 2005, 50, 544-553 |
| 9012665 | CIF | Ca9.434 F41.06 Ho0.48 Na1.958 Nd0.954 Y5.298 | R -3 :H | 17.02; 17.02; 9.679 90; 90; 120 | 2428.18 | Yakubovich, O. V.; Massa, W.; Pekov, I. V.; Gavrilenko, P. G. Crystal structure of tveitite-(Y): fractionation of rare-earth elements between positions and the variety of defects Crystallography Reports, 2007, 52, 71-79 |
| 9012666 | CIF | Al2 H4 O9 Si2 | C 1 c 1 | 8.91; 5.144; 14.593 90; 100.5; 90 | 657.642 | Zhukhlistov, A. P. Crystal structure of nacrite from the electron diffraction data Crystallography Reports, 2008, 53, 76-82 |
| 9012667 | CIF | Ca8 Cl2 Mg O16 Si4 | P 1 | 15.1; 15.11; 15.092 90.06; 90.01; 89.93 | 3443.4 | Rastsvetaeva, R. K.; Zadov, A. E.; Chukanov, N. V. Crystal structure of low-symmetry rondorfite Crystallography Reports, 2008, 53, 199-205 |
| 9012668 | CIF | C2 B3.468 F2 Mg9 O58 Pb14.144 Si10.532 | P -1 | 9.3409; 9.3579; 18.8333 80.365; 75.816; 59.87 | 1378.47 | Yakubovich, O. V.; Massa, W.; Chukanov, N. V. Crystal structure of britvinite [Pb7(OH)3F(BO3)2(CO3)][Mg4.5(OH)3(Si5O14)]: A new layered silicate with an original type of silicon-oxygen networks Crystallography Reports, 2008, 53, 206-215 |
| 9012669 | CIF | Al7.08 B3 Ca0.62 F0.84 Fe0.66 H2.28 Li0.99 Mg0.24 Na0.32 O30.15 Si6 Ti0.03 | R 3 m :H | 15.894; 15.894; 7.115 90; 90; 120 | 1556.58 | Rozhdestvenskaya, I. V.; Bronzova, Y. M.; Frank-Kamenetskaya O V; Zolotarev, A. A.; Kuznetsova, L. G.; Bannova, I. I. Refinement of the crystal structure of calcium-lithium-aluminum tourmaline from the pegmatite vein in the Sangilen Upland (Tuva Republic) Locality: Sangilen Upland, Tuva Republic Crystallography Reports, 2008, 53, 223-227 |
| 9012670 | CIF | Pt1.012 S0.988 | P 42/m m c | 3.471; 3.471; 6.1084 90; 90; 90 | 73.593 | Rozhdestvina, V. I.; Ivanov, A. V.; Zaremba, M. A.; Antsutkin, O. N.; Forsling, W. Single-crystalline cooperite (PtS): Crystal-chemical characterization, ESR spectroscopy, and 195Pt NMR Spectroscopy Locality: Sea of Okhotsk region, Maimakansk zone, Far East Crystallography Reports, 2008, 53, 391-397 |
| 9012671 | CIF | Pt1.001 S | P 42/m m c | 3.471; 3.471; 6.1084 90; 90; 90 | 73.593 | Rozhdestvina, V. I.; Ivanov, A. V.; Zaremba, M. A.; Antsutkin, O. N.; Forsling, W. Single-crystalline cooperite (PtS): Crystal-chemical characterization, ESR spectroscopy, and 195Pt NMR Spectroscopy Locality: Sea of Okhotsk region, Maimakansk zone, Far East Crystallography Reports, 2008, 53, 391-397 |
| 9012672 | CIF | Pt0.997 S1.003 | P 42/m m c | 3.471; 3.471; 6.1084 90; 90; 90 | 73.593 | Rozhdestvina, V. I.; Ivanov, A. V.; Zaremba, M. A.; Antsutkin, O. N.; Forsling, W. Single-crystalline cooperite (PtS): Crystal-chemical characterization, ESR spectroscopy, and 195Pt NMR Spectroscopy Locality: Sea of Okhotsk region, Maimakansk zone, Far East Crystallography Reports, 2008, 53, 391-397 |
| 9012673 | CIF | Fe0.001 Pt0.992 S1.007 | P 42/m m c | 3.471; 3.471; 6.1084 90; 90; 90 | 73.593 | Rozhdestvina, V. I.; Ivanov, A. V.; Zaremba, M. A.; Antsutkin, O. N.; Forsling, W. Single-crystalline cooperite (PtS): Crystal-chemical characterization, ESR spectroscopy, and 195Pt NMR Spectroscopy Locality: Sea of Okhotsk region, Maimakansk zone, Far East Crystallography Reports, 2008, 53, 391-397 |
| 9012674 | CIF | Fe0.001 Pt0.989 S1.01 | P 42/m m c | 3.471; 3.471; 6.1084 90; 90; 90 | 73.593 | Rozhdestvina, V. I.; Ivanov, A. V.; Zaremba, M. A.; Antsutkin, O. N.; Forsling, W. Single-crystalline cooperite (PtS): Crystal-chemical characterization, ESR spectroscopy, and 195Pt NMR Spectroscopy Locality: Sea of Okhotsk region, Maimakansk zone, Far East Crystallography Reports, 2008, 53, 391-397 |
| 9012675 | CIF | Pt0.982 S1.018 | P 42/m m c | 3.471; 3.471; 6.1084 90; 90; 90 | 73.593 | Rozhdestvina, V. I.; Ivanov, A. V.; Zaremba, M. A.; Antsutkin, O. N.; Forsling, W. Single-crystalline cooperite (PtS): Crystal-chemical characterization, ESR spectroscopy, and 195Pt NMR Spectroscopy Locality: Sea of Okhotsk region, Maimakansk zone, Far East Crystallography Reports, 2008, 53, 391-397 |
| 9012676 | CIF | Fe0.001 Pt0.98 S1.019 | P 42/m m c | 3.471; 3.471; 6.1084 90; 90; 90 | 73.593 | Rozhdestvina, V. I.; Ivanov, A. V.; Zaremba, M. A.; Antsutkin, O. N.; Forsling, W. Single-crystalline cooperite (PtS): Crystal-chemical characterization, ESR spectroscopy, and 195Pt NMR Spectroscopy Locality: Sea of Okhotsk region, Maimakansk zone, Far East Crystallography Reports, 2008, 53, 391-397 |
| 9012677 | CIF | Fe0.001 Pt0.974 S1.025 | P 42/m m c | 3.471; 3.471; 6.1084 90; 90; 90 | 73.593 | Rozhdestvina, V. I.; Ivanov, A. V.; Zaremba, M. A.; Antsutkin, O. N.; Forsling, W. Single-crystalline cooperite (PtS): Crystal-chemical characterization, ESR spectroscopy, and 195Pt NMR Spectroscopy Locality: Sea of Okhotsk region, Maimakansk zone, Far East Crystallography Reports, 2008, 53, 391-397 |
| 9012678 | CIF | Fe0.001 Pt0.97 S1.029 | P 42/m m c | 3.471; 3.471; 6.1084 90; 90; 90 | 73.593 | Rozhdestvina, V. I.; Ivanov, A. V.; Zaremba, M. A.; Antsutkin, O. N.; Forsling, W. Single-crystalline cooperite (PtS): Crystal-chemical characterization, ESR spectroscopy, and 195Pt NMR Spectroscopy Locality: Sea of Okhotsk region, Maimakansk zone, Far East Crystallography Reports, 2008, 53, 391-397 |
| 9012679 | CIF | Fe0.002 Pt0.964 S1.034 | P 42/m m c | 3.471; 3.471; 6.1084 90; 90; 90 | 73.593 | Rozhdestvina, V. I.; Ivanov, A. V.; Zaremba, M. A.; Antsutkin, O. N.; Forsling, W. Single-crystalline cooperite (PtS): Crystal-chemical characterization, ESR spectroscopy, and 195Pt NMR Spectroscopy Locality: Sea of Okhotsk region, Maimakansk zone, Far East Crystallography Reports, 2008, 53, 391-397 |
| 9012680 | CIF | Fe0.001 Pt0.954 S1.045 | P 42/m m c | 3.471; 3.471; 6.1084 90; 90; 90 | 73.593 | Rozhdestvina, V. I.; Ivanov, A. V.; Zaremba, M. A.; Antsutkin, O. N.; Forsling, W. Single-crystalline cooperite (PtS): Crystal-chemical characterization, ESR spectroscopy, and 195Pt NMR Spectroscopy Locality: Sea of Okhotsk region, Maimakansk zone, Far East Crystallography Reports, 2008, 53, 391-397 |
| 9012681 | CIF | Ca2 O4 Si | P b n m | 5.07389; 11.21128; 6.7534 90; 90; 90 | 384.166 | Gobechiya, E. R.; Yamnova, N. A.; Zadov, A. E.; Gazeev, V. M. Calcio-olivine gamma-Ca2SiO4: I. Rietveld refinement of the crystal structure Crystallography Reports, 2008, 53, 404-408 |
| 9012682 | CIF | Ba1.44 Ca0.76 F2 Fe6 H8 K0.8 Mg0.5 Mn1.5 Na Nb0.2 O38 Si8 Ti3.6 Zr0.2 | P 1 2/m 1 | 5.35; 6.909; 20.96 90; 99.83; 90 | 763.373 | Rastsvetaeva, R. K.; Chukanov, N. V.; Rozenberg, K. A crystal structure of jinshajiangite from the Norra Karr complex (Sweden) Crystallography Reports, 2008, 53, 553-556 |
| 9012683 | CIF | As0.66 Fe0.19 H20 Mg0.81 O22 P1.34 U2 | P 1 21/n 1 | 6.952; 19.865; 6.969 90; 90.806; 90 | 962.334 | Yakubovich, O. V.; Steele, I. M.; Atencio, D.; Menezes, L. A.; Chukanov, N. V. Crystal structure of the (Mg,Fe)[UO2(P,As)O4]2*10H2O solid solution- a novel mineral variety of saleeite Crystallography Reports, 2008, 53, 764-770 |
| 9012684 | CIF | As1.22 H12.72 N1.15 Na0.09 O18 P0.78 U2 | P 1 | 7.173; 7.167; 9.3 90.13; 90.09; 89.96 | 478.101 | Rastsvetaeva, R. K.; Sidorenko, G. A.; Ivanova, A. G.; Chukanov, N. V. Structural model of uramarsite Crystallography Reports, 2008, 53, 771-774 |
| 9012685 | CIF | Al24 Ca2.665 Cl H10 K8.076 Na21.256 O118.45 S5 Si24 | P 3 1 c | 12.856; 12.856; 42.256 90; 90; 120 | 6048.26 | Bonaccorsi, E. The crystal structure of giuseppettite, the 16-layer member of the cancrinite- sodalite group Locality: Sacrofano, Biachella Valley, Latium, Italy Microporous and Mesoporous Materials, 2004, 73, 129-136 |
| 9012686 | CIF | O7.5 Sc0.06 Ta2.94 | I 1 2 1 | 3.81; 3.81; 35.764 90; 90; 90 | 519.154 | Stephenson, N. C.; Roth, R. S. The crystal structure of the high temperature form of Ta2O2 Journal of Solid State Chemistry, 1971, 3, 145-153 |
| 9012687 | CIF | Na2 O7 Si2 Zr | P -1 | 6.66; 8.83; 5.42 92.75; 94.25; 72.33 | 302.756 | Voronkov, A. A.; Shumyatskaya, N. G.; Pyatenko, Y. A. Crystal structure of a new natural modification of Na2Zr[Si2O7] Journal of Structural Chemistry, 1970, 11, 866-867 |
| 9012688 | CIF | As2.79 Cu12.55 S16 V1.11 | P -4 3 n | 10.527; 10.527; 10.527 90; 90; 90 | 1166.58 | Frank-Kamenetskaya O V; Rozhdestvenskaya, I. V.; Yanulova, L. A. New data on the crystal structures of colusites and arsenosulvanites Sample: 1 Journal of Structural Chemistry, 2002, 43, 89-100 |
| 9012689 | CIF | As2.1 Cu12.67 Ge0.6 S16 Sb0.24 Sn0.06 V0.9 | P -4 3 n | 10.6; 10.6; 10.6 90; 90; 90 | 1191.02 | Frank-Kamenetskaya O V; Rozhdestvenskaya, I. V.; Yanulova, L. A. New data on the crystal structures of colusites and arsenosulvanites Sample: 2 Journal of Structural Chemistry, 2002, 43, 89-100 |
| 9012690 | CIF | As1.8 Cu12.92 S16 Sb0.3 Sn0.9 V | P -4 3 n | 10.653; 10.653; 10.653 90; 90; 90 | 1208.97 | Frank-Kamenetskaya O V; Rozhdestvenskaya, I. V.; Yanulova, L. A. New data on the crystal structures of colusites and arsenosulvanites Sample: 3 Journal of Structural Chemistry, 2002, 43, 89-100 |
| 9012691 | CIF | O2 Si | P 42/m n m | 4.1773; 4.1773; 2.6655 90; 90; 90 | 46.513 | Hill, R. J.; Newton, M. D.; Gibbs, G. V. A crystal chemical study of stishovite Journal of Solid State Chemistry, 1983, 47, 185-200 |
| 9012692 | CIF | Fe2 O3 | P 43 21 2 | 8.3396; 8.3396; 8.322 90; 90; 90 | 578.786 | Greaves, C. A powder neutron diffraction investigation of vacancy ordering and covalence in gamma-Fe2O3 Locality: synthetic Sample: T = 4 K Journal of Solid State Chemistry, 1983, 49, 325-333 |
| 9012693 | CIF | Li0.02 Na0.98 Nb O3 | P c 21 b | 5.494; 15.461; 5.551 90; 90; 90 | 471.517 | von der Muhll, R.; Sadel, A.; Hagenmuller, P. Structure cristalline a 295K de la phase ferroelectrique Li0.02Na0.98Nb O3 Note: x(O3) corrected to match reported bond lengths Journal of Solid State Chemistry, 1984, 51, 176-182 |
| 9012694 | CIF | O Pb | C m m a | 5.6124; 5.6089; 4.9924 90; 90; 90 | 157.158 | Boher, P.; Garnier, P.; Gavarri, J. R.; Hewat, A. W. Monoxyde quadratique PbO alpha(I): Description de la transition structurale ferroelastique Method: Neutron Diffraction T = 2 K Locality: synthetic Journal of Solid State Chemistry, 1985, 57, 343-350 |
| 9012695 | CIF | O Pb | C m m a | 5.6112; 5.6091; 4.9935 90; 90; 90 | 157.164 | Boher, P.; Garnier, P.; Gavarri, J. R.; Hewat, A. W. Monoxyde quadratique PbO alpha(I): Description de la transition structurale ferroelastique Method: Neutron Diffraction T = 30 K Locality: synthetic Journal of Solid State Chemistry, 1985, 57, 343-350 |
| 9012696 | CIF | O Pb | C m m a | 5.6118; 5.6114; 4.9988 90; 90; 90 | 157.412 | Boher, P.; Garnier, P.; Gavarri, J. R.; Hewat, A. W. Monoxyde quadratique PbO alpha(I): Description de la transition structurale ferroelastique Method: Neutron Diffraction T = 77 K Locality: synthetic Journal of Solid State Chemistry, 1985, 57, 343-350 |
| 9012697 | CIF | O Pb | C m m a | 5.6253; 5.6253; 5.0259 90; 90; 90 | 159.04 | Boher, P.; Garnier, P.; Gavarri, J. R.; Hewat, A. W. Monoxyde quadratique PbO alpha(I): Description de la transition structurale ferroelastique Method: Neutron Diffraction T = 300 K Locality: synthetic Journal of Solid State Chemistry, 1985, 57, 343-350 |
| 9012698 | CIF | O Pb | P 4/n m m :1 | 3.9645; 3.9645; 4.9956 90; 90; 90 | 78.517 | Boher, P.; Garnier, P.; Gavarri, J. R.; Hewat, A. W. Monoxyde quadratique PbO alpha(I): Description de la transition structurale ferroelastique Method: X-ray Diffraction T = 77.6 K Locality: synthetic Journal of Solid State Chemistry, 1985, 57, 343-350 |
| 9012699 | CIF | O Pb | P 4/n m m :1 | 3.9634; 3.9634; 5.0088 90; 90; 90 | 78.681 | Boher, P.; Garnier, P.; Gavarri, J. R.; Hewat, A. W. Monoxyde quadratique PbO alpha(I): Description de la transition structurale ferroelastique Method: X-ray Diffraction T = 182 K Locality: synthetic Journal of Solid State Chemistry, 1985, 57, 343-350 |
| 9012700 | CIF | O Pb | P 4/n m m :1 | 3.9744; 3.9744; 5.022 90; 90; 90 | 79.327 | Boher, P.; Garnier, P.; Gavarri, J. R.; Hewat, A. W. Monoxyde quadratique PbO alpha(I): Description de la transition structurale ferroelastique Method: X-ray Diffraction; in the cryostat T = 295 K Locality: synthetic Journal of Solid State Chemistry, 1985, 57, 343-350 |
| 9012701 | CIF | O Pb | P 4/n m m :1 | 3.9744; 3.9744; 5.0219 90; 90; 90 | 79.325 | Boher, P.; Garnier, P.; Gavarri, J. R.; Hewat, A. W. Monoxyde quadratique PbO alpha(I): Description de la transition structurale ferroelastique Method: X-ray Diffraction; in the four-circle diffractometer T = 295 K Locality: synthetic Journal of Solid State Chemistry, 1985, 57, 343-350 |
| 9012702 | CIF | O Pb | P 4/n m m :1 | 3.9854; 3.9854; 5.0435 90; 90; 90 | 80.108 | Boher, P.; Garnier, P.; Gavarri, J. R.; Hewat, A. W. Monoxyde quadratique PbO alpha(I): Description de la transition structurale ferroelastique Method: X-ray Diffraction T = 473 K Locality: synthetic Journal of Solid State Chemistry, 1985, 57, 343-350 |
| 9012703 | CIF | O Pb | P 4/n m m :1 | 3.9998; 3.9998; 5.0654 90; 90; 90 | 81.038 | Boher, P.; Garnier, P.; Gavarri, J. R.; Hewat, A. W. Monoxyde quadratique PbO alpha(I): Description de la transition structurale ferroelastique Method: X-ray Diffraction T = 673 K Locality: synthetic Journal of Solid State Chemistry, 1985, 57, 343-350 |
| 9012704 | CIF | O Pb | P 4/n m m :1 | 4.0039; 4.0039; 5.0712 90; 90; 90 | 81.297 | Boher, P.; Garnier, P.; Gavarri, J. R.; Hewat, A. W. Monoxyde quadratique PbO alpha(I): Description de la transition structurale ferroelastique Locality: synthetic Method: X-ray Diffraction T = 723 K Journal of Solid State Chemistry, 1985, 57, 343-350 |
| 9012706 | CIF | Fe | F m -3 m | 3.639; 3.639; 3.639 90; 90; 90 | 48.189 | Basinski, Z. S.; Hume-Rothery W; Sutton, A. L. The lattice expansion of iron Sample: at T = 1189 K Proceedings of the Royal Society of London A, 1955, 229, 459-467 |
| 9012707 | CIF | Fe | F m -3 m | 3.639; 3.639; 3.639 90; 90; 90 | 48.189 | Basinski, Z. S.; Hume-Rothery W; Sutton, A. L. The lattice expansion of iron Sample: at T = 1196 K Proceedings of the Royal Society of London A, 1955, 229, 459-467 |
| 9012708 | CIF | Fe | F m -3 m | 3.642; 3.642; 3.642 90; 90; 90 | 48.308 | Basinski, Z. S.; Hume-Rothery W; Sutton, A. L. The lattice expansion of iron Sample: at T = 1223 K Proceedings of the Royal Society of London A, 1955, 229, 459-467 |
| 9012709 | CIF | Fe | F m -3 m | 3.652; 3.652; 3.652 90; 90; 90 | 48.707 | Basinski, Z. S.; Hume-Rothery W; Sutton, A. L. The lattice expansion of iron Sample: at T = 1347 K Proceedings of the Royal Society of London A, 1955, 229, 459-467 |
| 9012710 | CIF | Fe | F m -3 m | 3.662; 3.662; 3.662 90; 90; 90 | 49.108 | Basinski, Z. S.; Hume-Rothery W; Sutton, A. L. The lattice expansion of iron Sample: at T = 1457 K Proceedings of the Royal Society of London A, 1955, 229, 459-467 |
| 9012711 | CIF | Fe | F m -3 m | 3.671; 3.671; 3.671 90; 90; 90 | 49.471 | Basinski, Z. S.; Hume-Rothery W; Sutton, A. L. The lattice expansion of iron Sample: at T = 1565 K Proceedings of the Royal Society of London A, 1955, 229, 459-467 |
| 9012712 | CIF | Fe | F m -3 m | 3.677; 3.677; 3.677 90; 90; 90 | 49.714 | Basinski, Z. S.; Hume-Rothery W; Sutton, A. L. The lattice expansion of iron Sample: at T = 1635 K Proceedings of the Royal Society of London A, 1955, 229, 459-467 |
| 9012713 | CIF | Fe | F m -3 m | 3.679; 3.679; 3.679 90; 90; 90 | 49.795 | Basinski, Z. S.; Hume-Rothery W; Sutton, A. L. The lattice expansion of iron Sample: at T = 1653 K Proceedings of the Royal Society of London A, 1955, 229, 459-467 |
| 9012714 | CIF | Fe | F m -3 m | 3.679; 3.679; 3.679 90; 90; 90 | 49.795 | Basinski, Z. S.; Hume-Rothery W; Sutton, A. L. The lattice expansion of iron Sample: at T = 1661 K Proceedings of the Royal Society of London A, 1955, 229, 459-467 |
| 9012715 | CIF | Cu2 H3 N O6 | P 21 21 21 | 6.087; 13.813; 5.597 90; 90; 90 | 470.594 | Bovio, B.; Locchi, S. Crystal structure of the orthorhombic basic copper nitrate, Cu2(OH)3NO3 Journal of Crystallographic and Spectroscopic Research, 1982, 12, 507-517 |
| 9012716 | CIF | F Mg2 O4 P | P 1 21/c 1 | 9.644; 12.679; 11.957 90; 108.3; 90 | 1388.11 | Coda, A.; Giuseppetti, G.; Tadini, C.; Carobbi, S. G. The crystal structure of wagnerite Atti della Accademia Nazionale dei Lincei, 1967, 43, 212-224 |
| 9012717 | CIF | As Ni0.808 Pd1.192 | P -6 2 c | 6.3165; 6.3165; 7.4278 90; 90; 120 | 256.652 | Evstigneeva, T.; Kabalov, Y.; Schneider, J. Crystal structure of PdNiAs, ordered member of isomorphous series Pd2As-Ni2As Materials Science Forum, 2000, 321, 700-705 |
| 9012718 | CIF | K2 O8 Pb S2 | R -3 m :H | 5.497; 5.497; 20.864 90; 90; 120 | 545.984 | Tissot, R. G.; Rodriguez, M. A.; Sipola, D. L.; Voigt, J. A. X-ray powder diffraction study of synthetic palmierite, K2Pb(SO4)2 Powder Diffraction, 2001, 16, 92-97 |
| 9012719 | CIF | Ca5 F O12 S1.5 Si1.5 | P 63/m | 9.44174; 9.44174; 6.93964 90; 90; 120 | 535.762 | Pajares, I.; De la Torre, A. G.; Martinez-Ramirez S; Puertas, F.; Blanco-Varela M T; Aranda, M. A. G. Quantitative analysis of mineralized white Portland clinkers: The structure of fluorellestadite Locality: synthetic Powder Diffraction, 2002, 17, 281-286 |
| 9012721 | CIF | Al0.828 Ca0.156 Fe0.772 Mg2.254 Mn3.1 Na2.624 O24 P6 | P 1 21/n 1 | 11.856; 12.411; 6.421 90; 114.45; 90 | 860.088 | Zhesheng, M.; Nicheng, S.; Zhizhong, P. Crystal structure of a new phosphatic mineral-qingheiite Locality: Northwestern Qinghe County, Altay Prefecture, Uygur Autonomous Region, Xinjiang Note: changed P3(z) to match reported bond distances Scientia Sinica, Series B, 1983, 26, 876-884 |
| 9012722 | CIF | Cs | F m -3 m | 6.465; 6.465; 6.465 90; 90; 90 | 270.213 | Weir, C. E.; Piermarini, G. J.; Block, S. On the crystal structures of Cs II and Ga II Sample: at room T Note: known as cesium-II Journal of Physical Chemistry, 1971, 54, 2768-2770 |
| 9012723 | CIF | Ga | I 4/m m m | 2.808; 2.808; 4.458 90; 90; 90 | 35.151 | Weir, C. E.; Piermarini, G. J.; Block, S. On the crystal structures of Cs II and Ga II Sample: at P > .002 GPa & room T Note: known as gallium-II Journal of Physical Chemistry, 1971, 54, 2768-2770 |
| 9012724 | CIF | Si | F m -3 m | 3.34; 3.34; 3.34 90; 90; 90 | 37.26 | Duclos, S. J.; Vohra, Y. K.; Ruoff, A. L. hcp-to-fcc transition in silicon at 78 GPa and studies to 100 GPa Sample: at P = 87 GPa Note: fcc structure stable above 78 GPa Physical Review Letters, 1987, 58, 775-777 |
| 9012725 | CIF | Cs | P 63/m m c | 3.011; 3.011; 4.855 90; 90; 90 | 44.016 | Takemura, K.; Shimomura, O.; Fujihisa, H. Cs(VI): a new high-pressure polymorph of cesium above 72 GPa Sample: at P = 92 GPa Note: stable above P = 72 GPa Note: known as cesium-VI Physical Review Letters, 1991, 66, 2014-2017 |
| 9012726 | CIF | Sr | F m -3 m | 6.076; 6.076; 6.076 90; 90; 90 | 224.312 | Hirst, R. G.; King, A. J.; Kanda, F. A. The barium-strontium equilibrium system Sample: at T = 25 C note: known as alpha-strontium Journal of Physical Chemistry, 1956, 60, 302-304 |
| 9012727 | CIF | Sr | I m -3 m | 4.87; 4.87; 4.87 90; 90; 90 | 115.501 | Hirst, R. G.; King, A. J.; Kanda, F. A. The barium-strontium equilibrium system Sample: at T = 628 C note: known as beta-strontium Journal of Physical Chemistry, 1956, 60, 302-304 |
| 9012728 | CIF | Sr | P 63/m m c | 4.28; 4.28; 7.05 90; 90; 120 | 111.843 | Hirst, R. G.; King, A. J.; Kanda, F. A. The barium-strontium equilibrium system Sample: at T = 225 C note: known as gamma-strontium Journal of Physical Chemistry, 1956, 60, 302-304 |
| 9012729 | CIF | Ba | I m -3 m | 5.013; 5.013; 5.013 90; 90; 90 | 125.978 | Hirst, R. G.; King, A. J.; Kanda, F. A. The barium-strontium equilibrium system Sample: at T = 25 C Journal of Physical Chemistry, 1956, 60, 302-304 |
| 9012730 | CIF | Ca | P 63/m m c | 4; 4; 6.5 90; 90; 120 | 90.067 | Schottmiller, J. C.; King, A. J.; Kanda, F. A. The calcium-strontium metal phase system Sample: at T = 415 C Journal of Physical Chemistry, 1958, 62, 1446-1449 |
| 9012731 | CIF | Ca | F m -3 m | 5.601; 5.601; 5.601 90; 90; 90 | 175.71 | Schottmiller, J. C.; King, A. J.; Kanda, F. A. The calcium-strontium metal phase system Sample: at T = 25 C Journal of Physical Chemistry, 1958, 62, 1446-1449 |
| 9012732 | CIF | Ca | I m -3 m | 4.488; 4.488; 4.488 90; 90; 90 | 90.398 | Schottmiller, J. C.; King, A. J.; Kanda, F. A. The calcium-strontium metal phase system Sample: at T = 615 C Journal of Physical Chemistry, 1958, 62, 1446-1449 |
| 9012733 | CIF | D2 O | F d -3 m :2 | 17.103; 17.103; 17.103 90; 90; 90 | 5002.84 | Jones, C. Y.; Marshall, S. L.; Chakoumakos, B. C.; Rawn, C. J.; Ishii, Y. Structure and thermal expansivity of tetrahydrofuran deuterate determined by neutron powder diffraction Sample: T = 7 K, host lattice Note: y(D7) corrected Journal of Physical Chemistry B, 2003, 107, 6026-6031 |
| 9012734 | CIF | D2 O | F d -3 m :2 | 17.109; 17.109; 17.109 90; 90; 90 | 5008.11 | Jones, C. Y.; Marshall, S. L.; Chakoumakos, B. C.; Rawn, C. J.; Ishii, Y. Structure and thermal expansivity of tetrahydrofuran deuterate determined by neutron powder diffraction Sample: T = 75 K, host lattice Journal of Physical Chemistry B, 2003, 107, 6026-6031 |
| 9012735 | CIF | D2 O | F d -3 m :2 | 17.15; 17.15; 17.15 90; 90; 90 | 5044.2 | Jones, C. Y.; Marshall, S. L.; Chakoumakos, B. C.; Rawn, C. J.; Ishii, Y. Structure and thermal expansivity of tetrahydrofuran deuterate determined by neutron powder diffraction Sample: T = 140 K, host lattice Journal of Physical Chemistry B, 2003, 107, 6026-6031 |
| 9012736 | CIF | D2 O | F d -3 m :2 | 17.198; 17.198; 17.198 90; 90; 90 | 5086.67 | Jones, C. Y.; Marshall, S. L.; Chakoumakos, B. C.; Rawn, C. J.; Ishii, Y. Structure and thermal expansivity of tetrahydrofuran deuterate determined by neutron powder diffraction Sample: T = 205 K, host lattice Journal of Physical Chemistry B, 2003, 107, 6026-6031 |
| 9012737 | CIF | D2 O | F d -3 m :2 | 17.262; 17.262; 17.262 90; 90; 90 | 5143.67 | Jones, C. Y.; Marshall, S. L.; Chakoumakos, B. C.; Rawn, C. J.; Ishii, Y. Structure and thermal expansivity of tetrahydrofuran deuterate determined by neutron powder diffraction Sample: T = 265 K, host lattice Journal of Physical Chemistry B, 2003, 107, 6026-6031 |
| 9012738 | CIF | C0.333 H0.667 O0.083 | F d -3 m :2 | 17.103; 17.103; 17.103 90; 90; 90 | 5002.84 | Jones, C. Y.; Marshall, S. L.; Chakoumakos, B. C.; Rawn, C. J.; Ishii, Y. Structure and thermal expansivity of tetrahydrofuran deuterate determined by neutron powder diffraction Sample: cell T = 7 K, positions T = 5 K, guest molecule Note: occupancies of C11 and H14 switched to reproduce reported formula Journal of Physical Chemistry B, 2003, 107, 6026-6031 |
| 9012739 | CIF | O6 Sb2 Zn | P 42/m n m | 4.66; 4.66; 9.24 90; 90; 90 | 200.652 | Bystrom, A.; Hok, B.; Mason, B. The crystal structure of zinc metantimonate and similar compounds Arkiv for Kemi, Mineralogi och Geologi,, 1942, 1-8 |
| 9012740 | CIF | Cu O6 Sb2 | P 1 21/c 1 | 4.62; 4.62; 9.28 90; 88.5; 90 | 198.008 | Bystrom, A.; Hok, B.; Mason, B. The crystal structure of zinc metantimonate and similar compounds Arkiv for Kemi, Mineralogi och Geologi,, 1942, 1-8 |
| 9012741 | CIF | K O6 U V | P 1 21/c 1 | 6.59; 8.403; 10.43 90; 104.2; 90 | 559.922 | Sundberg, I.; Sillen, L. G. On the crystal structure of KUO2VO4 (synthetic anhydrous carnotite) Arkiv for Kemi, 1949, 1, 337-351 |
| 9012742 | CIF | Ca O10 S6 Sb10 | C 1 2/c 1 | 25.33; 5.655; 16.88 90; 117.51; 90 | 2144.52 | Nakai, I.; Koto, K.; Nagashima, K.; Morimoto, N. The crystal structure of sarabauite CaSb10O10S6, a new oxide sulfide mineral Chemistry Letters, 1977, 1977, 275-276 |
| 9012743 | CIF | Be4 Ca3 K2 Li0.25 Na3.75 O38 Si12 Ti2 | F d d d :2 | 14.243; 13.045; 33.4839 90; 90; 90 | 6221.31 | Rastsvetaeva, R. K.; Evsyunin, V. G.; Kashaev, A. A. Crystal structure of a new representative of ring silicates Doklady Chemistry, 1995, 340, 49-51 |
| 9012744 | CIF | Dy0.3 Gd0.2 H12 Na5 Nb0.2 O24 Si6 Ti0.8 Y0.5 | R 3 2 :H | 10.696; 10.696; 15.728 90; 90; 120 | 1558.29 | Rastsvetaeva, R. K.; Khomyakov, A. P. Crystal structure of pyatenkoite-(Y) Na5YTiSi6O18*6H2O, a new mineral of the hilairite group: crystal structure Doklady Chemistry, 1996, 351, 283-286 |
| 9012745 | CIF | H1.23 K0.875 Na0.43 Nb0.3 O7.89 Si2 Ti0.7 | C 1 2/m 1 | 14.39; 13.9; 7.825 90; 117.6; 90 | 1387.05 | Rastsvetaeva, R. K.; Arakcheeva, A. V.; Khomyakov, A. P. Crystal structure and microtwinning of a new monoclinic analog of nenadkevichite Doklady Chemistry, 1996, 351, 294-297 |
| 9012746 | CIF | Al0.745 Cu F0.73 H4.5 O4 | C 1 2/m 1 | 12.326; 2.907; 10.369 90; 97.9; 90 | 368.013 | Rastsvetaeva, R. K.; Chukanov, N. V.; Karpenko, V. Y. Crystal structure of new native compound Cu4Al3(OH)14F3(H2O)2 Doklady Chemistry, 1997, 353, 45-48 |
| 9012747 | CIF | Ba0.033 Ca6.333 Ce0.468 Cl1.6 Fe2.55 H7.38 K0.249 Mn1.188 Na12 Nb0.8 O81.18 Si25.2 Sr0.717 Ti0.06 Y0.132 Zr3.27 | R 3 m :H | 14.262; 14.262; 29.949 90; 90; 120 | 5275.62 | Ekimenkova, I. A.; Rastsvetaeva, R. K.; Khomyakov, A. P. Crystal structure of the Fe,Cl-analogue of kentbrooksite Doklady Chemistry, 2000, 370, 17-20 |
| 9012748 | CIF | Ba0.08 Fe0.02 H11.94 K0.44 Na1.09 Nb1.8 O32.44 Si8 Sr0.2 Ti2.2 | C 1 m 1 | 14.604; 14.274; 7.933 90; 117.4; 90 | 1468.17 | Rastsvetaeva, R. K.; Organova, N. I.; Rozhdestvenskaya, I. V.; Shlyukova, Z. V.; Chukanov, N. V. Crystal structure of oxonium mineral of the nenadkevichite-labuntsovite group from Khibiny massif Locality: Khibinpakhchorr mountain, Khibiny massif, Kola Peninsula, Russia Doklady Chemistry, 2000, 371, 52-56 |
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