Crystallography Open Database
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COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 9017067 | CIF | Al2.455 Mg0.79 Na0.33 O6 Si0.63 | P 63/m | 8.7225; 8.7225; 2.7664 90; 90; 120 | 182.275 | Pamato, M. G.; Kurnosov, A.; Ballaran, T. B.; Trots, D. M.; Caracas, R.; Frost, D. J. Hexagonal Na0.41[Na0.125Mg0.79Al0.085]2[Al0.79Si0.21]6O12 (NAL phase): Crystal structure refinement and elasticity American Mineralogist, 2014, 99, 1562-1569 |
| 9017068 | CIF | Ca0.056 H Mn1.944 Na O9 Si3 | P -1 | 7.6844; 6.8913; 6.73493 90.4576; 94.0805; 102.777 | 346.835 | Williams, E. R.; Weller, M. T. A variable-temperature neutron diffraction study of serandite: A Mn-silicate framework with a very strong, two-proton site, hydrogen bond Note: T = 4 K American Mineralogist, 2014, 99, 1755-1760 |
| 9017069 | CIF | Ca0.053 H Mn1.947 Na O9 Si3 | P -1 | 7.6888; 6.8934; 6.73781 90.4467; 94.0672; 102.777 | 347.296 | Williams, E. R.; Weller, M. T. A variable-temperature neutron diffraction study of serandite: A Mn-silicate framework with a very strong, two-proton site, hydrogen bond Note: T = 150 K American Mineralogist, 2014, 99, 1755-1760 |
| 9017070 | CIF | Ca0.058 H Mn1.942 Na O9 Si3 | P -1 | 7.70244; 6.9003; 6.7447 90.4159; 94.0442; 102.801 | 348.599 | Williams, E. R.; Weller, M. T. A variable-temperature neutron diffraction study of serandite: A Mn-silicate framework with a very strong, two-proton site, hydrogen bond Note: T = 298 K American Mineralogist, 2014, 99, 1755-1760 |
| 9017071 | CIF | Ca0.074 H Mn1.926 Na O9 Si3 | P -1 | 7.7283; 6.9174; 6.7608 90.362; 94.016; 102.822 | 351.464 | Williams, E. R.; Weller, M. T. A variable-temperature neutron diffraction study of serandite: A Mn-silicate framework with a very strong, two-proton site, hydrogen bond Note: T = 575 K American Mineralogist, 2014, 99, 1755-1760 |
| 9017072 | CIF | Ca0.074 H Mn1.926 Na O9 Si3 | P -1 | 7.7513; 6.9384; 6.7761 90.307; 94.019; 102.858 | 354.335 | Williams, E. R.; Weller, M. T. A variable-temperature neutron diffraction study of serandite: A Mn-silicate framework with a very strong, two-proton site, hydrogen bond Note: T = 800 K American Mineralogist, 2014, 99, 1755-1760 |
| 9017073 | CIF | H28 K0.216 Mg2 N0.784 Na O22 P2 | P m n b | 6.9661; 25.236; 11.2919 90; 90; 90 | 1985.08 | Yang, H.; Martinelli, L.; Tasso, F.; Sprocati, A. R.; Pinzari, F.; Liu, Z.; Downs, R. T.; Sun, H. J. A new biogenic, struvite-related phosphate, the ammonium-analog of hazenite, (NH4)NaMg2(PO4)2*14H2O American Mineralogist, 2014, 99, 1761-1766 |
| 9017074 | CIF | Al3.08 B3 Ca0.07 Cr3.47 F0.25 Fe0.01 H3.02 K0.02 Mg2.25 Na0.87 O30.75 Si5.96 V0.22 | R 3 m :H | 16.0277; 16.0277; 7.3085 90; 90; 120 | 1625.93 | Reznitskii, L.; Clark, C. M.; Hawthorne, F. C.; Grice, J. D.; Skogby, H.; Halenius, U.; Bosi, F. Chromo-alumino-povondraite, NaCr3(Al4Mg2)(Si6O18)(BO3)3(OH)3O, a new mineral species of the tourmaline supergroup American Mineralogist, 2014, 99, 1767-1773 |
| 9017075 | CIF | H12 N2 O12 S2 U | P 1 21/c 1 | 7.736; 7.3712; 20.856 90; 102.123; 90 | 1162.76 | Pekov, I. V.; Krivovichev, S. V.; Yapaskurt, V. O.; Chukanov, N. V.; Belakovskiy, D. I. Beshtauite, (NH4)2(UO2)(SO4)2*2H2O, a new mineral from Mount Beshtau, Northern Caucasus, Russia American Mineralogist, 2014, 99, 1783-1787 |
| 9017076 | CIF | Cr2 Fe O4 | P n m a | 9.0633; 2.95793; 10.6391 90; 90; 90 | 285.219 | Ishii, T.; Kojitani, H.; Tsukamoto, S.; Fujino, K.; Mori, D.; Inaguma, Y.; Tsujino, N.; Yoshino, T.; Yamazaki, D.; Higo, Y.; Funakoshi, K.; Akaogi, M. High-pressure phase transitions in FeCr2O4 and structure analysis of new post- spinel FeCr2O4 and Fe2Cr2O5 phases with meteoritical and petrological implications American Mineralogist, 2014, 99, 1788-1797 |
| 9017077 | CIF | Cr2 Fe O4 | C m c m | 2.88445; 9.5207; 9.7532 90; 90; 90 | 267.842 | Ishii, T.; Kojitani, H.; Tsukamoto, S.; Fujino, K.; Mori, D.; Inaguma, Y.; Tsujino, N.; Yoshino, T.; Yamazaki, D.; Higo, Y.; Funakoshi, K.; Akaogi, M. High-pressure phase transitions in FeCr2O4 and structure analysis of new post- spinel FeCr2O4 and Fe2Cr2O5 phases with meteoritical and petrological implications American Mineralogist, 2014, 99, 1788-1797 |
| 9017078 | CIF | Cr2 Fe2 O5 | P b a m | 9.6642; 12.5; 2.9023 90; 90; 90 | 350.605 | Ishii, T.; Kojitani, H.; Tsukamoto, S.; Fujino, K.; Mori, D.; Inaguma, Y.; Tsujino, N.; Yoshino, T.; Yamazaki, D.; Higo, Y.; Funakoshi, K.; Akaogi, M. High-pressure phase transitions in FeCr2O4 and structure analysis of new post- spinel FeCr2O4 and Fe2Cr2O5 phases with meteoritical and petrological implications American Mineralogist, 2014, 99, 1788-1797 |
| 9017079 | CIF | H Mg0.5 O2 Si0.5 | P n n m | 4.733; 4.325; 2.842 90; 90; 90 | 58.176 | Bindi, L.; Nishi, M.; Tsuchiya, J.; Irifune, T. Crystal chemistry of dense hydrous magnesium silicates: The structure of phase H, MgSiH2O4, synthesized at 45 GPa and 1000 C American Mineralogist, 2014, 99, 1802-1805 |
| 9017080 | CIF | Al0.07 Be2.93 Ca1.08 H1.84 K Na0.02 O30.92 Si12 Y0.91 Yb0.01 | P 6/m c c | 10.3476; 10.3476; 13.761 90; 90; 120 | 1276.03 | Hawthorne, F. C.; Abdu, Y. A.; Ball, N. A.; Cerny, P.; Kristiansen, R. Agakhanovite-(Y), ideally (YCa)2KBe3Si12O30, a new milarite-group mineral from the Heftetjern pegmatite, Tordal, Southern Norway: description and crystal structure American Mineralogist, 2014, 99, 2084-2088 |
| 9017081 | CIF | H6 Mo2 O11 Th | P 1 21/c 1 | 9.6797; 10.3771; 9.3782 90; 90; 90 | 942.014 | Orlandi, P.; Biagioni, C.; Bindi, L.; Nestola, F. Ichnusaite, Th(MoO4)2*3H2O, the first natural thorium molybdate: occurrence, description, and crystal structure American Mineralogist, 2014, 99, 2089-2094 |
| 9017082 | CIF | Al1.99 Fe0.04 O4 Zn0.97 | F d -3 m :2 | 8.0912; 8.0912; 8.0912 90; 90; 90 | 529.711 | Fregola, R. A.; Skogby, H.; Bosi, F.; D'Ippolito V; Andreozzi, G. B.; Halenius, U. Optical absorption spectroscopy study of the causes for color variations in natural Fe-bearing gahnite: Insights from iron valency and site distribution data Note: Sample Ni8967d American Mineralogist, 2014, 99, 2187-2195 |
| 9017083 | CIF | Al1.98 Fe0.1 Mg0.01 O4 Zn0.91 | F d -3 m :2 | 8.0954; 8.0954; 8.0954 90; 90; 90 | 530.536 | Fregola, R. A.; Skogby, H.; Bosi, F.; D'Ippolito V; Andreozzi, G. B.; Halenius, U. Optical absorption spectroscopy study of the causes for color variations in natural Fe-bearing gahnite: Insights from iron valency and site distribution data Note: Sample Ni8967e American Mineralogist, 2014, 99, 2187-2195 |
| 9017084 | CIF | Al1.98 Fe0.1 Mg0.01 O4 Zn0.91 | F d -3 m :2 | 8.0944; 8.0944; 8.0944 90; 90; 90 | 530.34 | Fregola, R. A.; Skogby, H.; Bosi, F.; D'Ippolito V; Andreozzi, G. B.; Halenius, U. Optical absorption spectroscopy study of the causes for color variations in natural Fe-bearing gahnite: Insights from iron valency and site distribution data Note: Sample Sp2781_6a American Mineralogist, 2014, 99, 2187-2195 |
| 9017085 | CIF | Al1.92 Fe0.35 Mg0.03 O4 Zn0.7 | F d -3 m :2 | 8.1103; 8.1103; 8.1103 90; 90; 90 | 533.471 | Fregola, R. A.; Skogby, H.; Bosi, F.; D'Ippolito V; Andreozzi, G. B.; Halenius, U. Optical absorption spectroscopy study of the causes for color variations in natural Fe-bearing gahnite: Insights from iron valency and site distribution data Note: Sample Sp2781_6c American Mineralogist, 2014, 99, 2187-2195 |
| 9017086 | CIF | Al0.22 Cr0.3 Fe2.15 Mg0.26 O4 Si0.08 | A m a m | 9.8; 9.6; 2.87 90; 90; 90 | 270.01 | Koch-Muller M; Mugnaioli, E.; Rhede, D.; Speziale, S.; Kolb, U.; Wirth, R. Synthesis of a quenchable high-pressure form of magnetite (h-Fe3O4) with composition Fe1(Fe2+0.75Mg0.26)Fe2(Fe3+0.70Cr0.15Al0.11Si0.04)2O4 Note: Sample Crystal 1 American Mineralogist, 2014, 99, 2405-2415 |
| 9017087 | CIF | Al0.22 Cr0.3 Fe2.15 Mg0.26 O4 Si0.08 | A m a m | 9.8; 9.6; 2.87 90; 90; 90 | 270.01 | Koch-Muller M; Mugnaioli, E.; Rhede, D.; Speziale, S.; Kolb, U.; Wirth, R. Synthesis of a quenchable high-pressure form of magnetite (h-Fe3O4) with composition Fe1(Fe2+0.75Mg0.26)Fe2(Fe3+0.70Cr0.15Al0.11Si0.04)2O4 Note: Sample Crystal 2 American Mineralogist, 2014, 99, 2405-2415 |
| 9017088 | CIF | Ca0.96 Ce0.01 H4 O17 Si6 Yb0.01 Zr0.99 | C 1 2/m 1 | 14.0178; 14.1289; 7.8366 90; 109.436; 90 | 1463.64 | Mesto, E.; Kaneva, E.; Schingaro, E.; Vladykin, N.; Lacalamita, M.; Scordari, F. Armstrongite from Khan Bogdo (Mongolia): Crystal structure determination and implications for zeolite-like cation exchange properties American Mineralogist, 2014, 99, 2424-2432 |
| 9017089 | CIF | Al0.38 Fe0.3 Ni0.32 | I m -3 m | 3.0214; 3.0214; 3.0214 90; 90; 90 | 27.582 | Bindi, L.; Yao, N.; Lin, C.; Hollister, L. S.; MacPherson, G. J.; Poirier, G. R.; Andronicos, C. L.; Distler, V. V.; Eddy, M. P.; Kostin, A.; Kryachko, V.; Steinhardt, W. M.; Yudovskaya, M. Steinhardtite, a new body-centered-cubic allotropic form of aluminum from the Khatyrka CV3 carbonaceous chondrite American Mineralogist, 2014, 99, 2433-2436 |
| 9017090 | CIF | Fe1.946 O3 | I 1 2/a 1 | 7.3951; 5.0117; 5.4417 90; 95.666; 90 | 200.695 | Peterson, K. M.; Heaney, P. J.; Post, J. E.; Eng, P. J. A refined monoclinic structure for a variety of "hydrohematite" Note: T = 38 C American Mineralogist, 2015, 100, 570-579 |
| 9017091 | CIF | H2 O10 S Sb4 | P c a 21 | 5.7563; 11.2538; 14.8627 90; 90; 90 | 962.809 | Roper, A. J.; Leverett, P.; Murphy, T. D.; Williams, P. A.; Hibbs, D. E. Klebelsbergite, Sb4O4SO4(OH)2: Stability relationships, formation in nature, and refinement of its structure American Mineralogist, 2015, 100, 602-607 |
| 9017092 | CIF | Fe2.017 Mg1.983 O5 | C m c m | 2.8889; 9.7282; 12.5523 90; 90; 90 | 352.767 | Ballaran, T. B.; Uenver-Thiele L; Woodland, A. B. Complete substitution of Fe2+ by Mg in Fe4O5: The crystal structure of the Mg2Fe2O5 end-member American Mineralogist, 2015, 100, 628-632 |
| 9017093 | CIF | Al Li O10 Si4 | P 1 2/c 1 | 11.22955; 5.1396; 11.7514 90; 141.312; 90 | 423.952 | Ross, N. L.; Zhao, J.; Slebodnick, C.; Spencer, E. C.; Chakoumakos, B. C. Petalite under pressure: Elastic behavior and phase stability Note: P = 0.0001 GPa American Mineralogist, 2015, 100, 714-721 |
| 9017094 | CIF | Al Li O10 Si4 | P 1 2/c 1 | 11.2067; 5.1228; 11.716 90; 141.243; 90 | 421.069 | Ross, N. L.; Zhao, J.; Slebodnick, C.; Spencer, E. C.; Chakoumakos, B. C. Petalite under pressure: Elastic behavior and phase stability Note: P = 0.32 GPa American Mineralogist, 2015, 100, 714-721 |
| 9017095 | CIF | Al Li O10 Si4 | P 1 2/c 1 | 11.1895; 5.11; 11.6872 90; 141.19; 90 | 418.826 | Ross, N. L.; Zhao, J.; Slebodnick, C.; Spencer, E. C.; Chakoumakos, B. C. Petalite under pressure: Elastic behavior and phase stability Note: P = 0.56 GPa American Mineralogist, 2015, 100, 714-721 |
| 9017096 | CIF | Al Li O10 Si4 | P 1 2/c 1 | 11.1705; 5.0963; 11.6569 90; 141.134; 90 | 416.413 | Ross, N. L.; Zhao, J.; Slebodnick, C.; Spencer, E. C.; Chakoumakos, B. C. Petalite under pressure: Elastic behavior and phase stability Note: P = 0.89 GPa American Mineralogist, 2015, 100, 714-721 |
| 9017097 | CIF | Al Li O10 Si4 | P 1 2/c 1 | 11.1425; 5.0723; 11.6092 90; 141.074; 90 | 412.257 | Ross, N. L.; Zhao, J.; Slebodnick, C.; Spencer, E. C.; Chakoumakos, B. C. Petalite under pressure: Elastic behavior and phase stability Note: P = 1.25 GPa American Mineralogist, 2015, 100, 714-721 |
| 9017098 | CIF | Al3 Li3 O30 Si12 | P 1 2/c 1 | 10.8301; 5.053; 33.59 90; 140.665; 90 | 1165.15 | Ross, N. L.; Zhao, J.; Slebodnick, C.; Spencer, E. C.; Chakoumakos, B. C. Petalite under pressure: Elastic behavior and phase stability Note: P = 2.71 GPa American Mineralogist, 2015, 100, 714-721 |
| 9017099 | CIF | Al0.62 Ca0.11 F0.03 Fe0.486 H1.97 K0.067 Mg3.884 Mn0.01 Na2.829 O23.97 Si8 | C 1 2/m 1 | 9.8087; 17.8448; 5.2905 90; 103.66; 90 | 899.826 | Oberti, R.; Boiocchi, M.; Hawthorne, F. C.; Ball, N. A.; Harlow, G. E. Eckermannite revised: The new holotype from the Jade Mine Tract, Myanmar-crystal structure, mineral data, and hints on the reasons for the rarity of eckermannite Note: Sample AMNH H108401 American Mineralogist, 2015, 100, 909-914 |
| 9017100 | CIF | Ca1.39 Cl0.72 Fe0.26 H0.28 Mn3.41 O12.28 P3 | P 63/m | 9.504; 9.504; 6.347 90; 90; 120 | 496.492 | Tait, K.; Ball, N. A.; Hawthorne, F. C. Pieczkaite, ideally Mn5(PO4)3Cl, a new apatite-supergroup mineral from Cross Lake, Manitoba, Canada: Description and crystal structure American Mineralogist, 2015, 100, 1047-1052 |
| 9017101 | CIF | Cs0.44 H20.16 Hf0.04 K0.48 Na7.04 Nb0.08 O70.08 Si24 Y0.68 Zr3.28 | C 1 2/m 1 | 14.5975; 14.11; 14.4394 90; 90.0399; 90 | 2974.09 | Agakhanov, A. A.; Pautov, L. A.; Karpenko, V. Y.; Sokolova, E.; Abdu, Y. A.; Hawthorne, F. C.; Pekov, I. V.; Siidra, O. I. Yusupovite, Na2Zr(Si6O15)(H2O)3, a new mineral species from the Darai-Pioz alkaline massif and its implications as a new microporous filter for large ions American Mineralogist, 2015, 100, 1502-1508 |
| 9017102 | CIF | C Ca0.04 Mn0.96 O3 | R -3 c :H | 4.7903; 4.7903; 15.72 90; 90; 120 | 312.398 | Merlini, M.; Hanfland, M.; Gemmi, M. The MnCO3-II high-pressure polymorph of rhodocrosite Note: Sample run1-p0 Note: P = .0001 GPa American Mineralogist, 2015, 100, 2625-2629 |
| 9017103 | CIF | C Ca0.04 Mn0.96 O3 | R -3 c :H | 4.6581; 4.6581; 14.213 90; 90; 120 | 267.075 | Merlini, M.; Hanfland, M.; Gemmi, M. The MnCO3-II high-pressure polymorph of rhodocrosite Note: Sample run1-p1 Note: P = 22.50 GPa American Mineralogist, 2015, 100, 2625-2629 |
| 9017104 | CIF | C Ca0.04 Mn0.96 O3 | R -3 c :H | 4.6554; 4.6554; 14.149 90; 90; 120 | 265.565 | Merlini, M.; Hanfland, M.; Gemmi, M. The MnCO3-II high-pressure polymorph of rhodocrosite Note: Sample run1-p2 Note: P = 23.65 GPa American Mineralogist, 2015, 100, 2625-2629 |
| 9017105 | CIF | C Ca0.04 Mn0.96 O3 | R -3 c :H | 4.6473; 4.6473; 14.075 90; 90; 120 | 263.257 | Merlini, M.; Hanfland, M.; Gemmi, M. The MnCO3-II high-pressure polymorph of rhodocrosite Note: Sample run1-p3 Note: P = 25.34 GPa American Mineralogist, 2015, 100, 2625-2629 |
| 9017106 | CIF | C Ca0.04 Mn0.96 O3 | R -3 c :H | 4.6416; 4.6416; 13.967 90; 90; 120 | 260.597 | Merlini, M.; Hanfland, M.; Gemmi, M. The MnCO3-II high-pressure polymorph of rhodocrosite Note: Sample run1-p4 Note: P = 27.45 GPa American Mineralogist, 2015, 100, 2625-2629 |
| 9017107 | CIF | C Ca0.04 Mn0.96 O3 | R -3 c :H | 4.6301; 4.6301; 13.83 90; 90; 120 | 256.764 | Merlini, M.; Hanfland, M.; Gemmi, M. The MnCO3-II high-pressure polymorph of rhodocrosite Note: Sample run1-p5 Note: P = 30.48 GPa American Mineralogist, 2015, 100, 2625-2629 |
| 9017108 | CIF | C Ca0.04 Mn0.96 O3 | R -3 c :H | 4.6278; 4.6278; 13.797 90; 90; 120 | 255.897 | Merlini, M.; Hanfland, M.; Gemmi, M. The MnCO3-II high-pressure polymorph of rhodocrosite Note: Sample run1-p6 Note: P = 31.19 GPa American Mineralogist, 2015, 100, 2625-2629 |
| 9017109 | CIF | C Ca0.04 Mn0.96 O3 | R -3 c :H | 4.6193; 4.6193; 13.696 90; 90; 120 | 253.091 | Merlini, M.; Hanfland, M.; Gemmi, M. The MnCO3-II high-pressure polymorph of rhodocrosite Note: Sample run1-p7 Note: P = 33.56 GPa American Mineralogist, 2015, 100, 2625-2629 |
| 9017110 | CIF | C Ca0.04 Mn0.96 O3 | R -3 c :H | 4.61; 4.61; 13.582 90; 90; 120 | 249.975 | Merlini, M.; Hanfland, M.; Gemmi, M. The MnCO3-II high-pressure polymorph of rhodocrosite Note: Sample run1-p8 Note: P = 36.20 GPa American Mineralogist, 2015, 100, 2625-2629 |
| 9017111 | CIF | C Ca0.04 Mn0.96 O3 | R -3 c :H | 4.6024; 4.6024; 13.517 90; 90; 120 | 247.959 | Merlini, M.; Hanfland, M.; Gemmi, M. The MnCO3-II high-pressure polymorph of rhodocrosite Note: Sample run1-p9 Note: P = 37.58 GPa American Mineralogist, 2015, 100, 2625-2629 |
| 9017112 | CIF | C Ca0.04 Mn0.96 O3 | R -3 c :H | 4.5927; 4.5927; 13.332 90; 90; 120 | 243.535 | Merlini, M.; Hanfland, M.; Gemmi, M. The MnCO3-II high-pressure polymorph of rhodocrosite Note: Sample run1-p10 Note: P = 40.80 GPa American Mineralogist, 2015, 100, 2625-2629 |
| 9017113 | CIF | C Ca0.04 Mn0.96 O3 | P -1 | 2.936; 4.841; 5.568 100.82; 94.93; 90.18 | 77.429 | Merlini, M.; Hanfland, M.; Gemmi, M. The MnCO3-II high-pressure polymorph of rhodocrosite Note: Sample run1-p11 Note: P = 44.46 GPa American Mineralogist, 2015, 100, 2625-2629 |
| 9017114 | CIF | C Ca0.04 Mn0.96 O3 | P -1 | 2.928; 4.816; 5.545 101.71; 94.99; 89.9 | 76.264 | Merlini, M.; Hanfland, M.; Gemmi, M. The MnCO3-II high-pressure polymorph of rhodocrosite Note: Sample run1-p11a Note: P = 46.79 GPa American Mineralogist, 2015, 100, 2625-2629 |
| 9017115 | CIF | C Ca0.04 Mn0.96 O3 | P -1 | 2.934; 4.839; 5.557 101.87; 95.29; 89.73 | 76.872 | Merlini, M.; Hanfland, M.; Gemmi, M. The MnCO3-II high-pressure polymorph of rhodocrosite Note: Sample run1-p12 Note: P = 44.01 GPa American Mineralogist, 2015, 100, 2625-2629 |
| 9017116 | CIF | C Ca0.04 Mn0.96 O3 | P -1 | 2.94; 4.856; 5.584 101.99; 95.58; 89.65 | 77.604 | Merlini, M.; Hanfland, M.; Gemmi, M. The MnCO3-II high-pressure polymorph of rhodocrosite Note: Sample run1-p13 Note: P = 41.55 GPa American Mineralogist, 2015, 100, 2625-2629 |
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