Crystallography Open Database

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9000719 CIFAl2 O5 SiP n n m7.8976; 7.9735; 5.5695
90; 90; 90
350.72Winter, J. K.; Ghose, S.
Thermal expansion and high-temperature crystal chemistry of the Al2SiO5 polymorphs T = 1000 deg C
American Mineralogist, 1979, 64, 573-586
9000814 CIFCa4 F H16 Na O28 Si8P n n m8.875; 8.881; 15.79
90; 90; 90
1244.55Miura Y; Kato T; Rucklidge J C; Matsueda H
Natroapophyllite, a new orthorhombic sodium analog of apophyllite II. Crystal structure
American Mineralogist, 1981, 66, 410-423
9000816 CIFAl1.14 Mn0.86 O5 SiP n n m7.959; 8.047; 5.616
90; 90; 90
359.683Weiss, Z.; Bailey, S. W.; Rieder, M.
Refinement of the crystal structure of kanonaite, (Mn,Al)(Al,Mn)O[SiO4]
American Mineralogist, 1981, 66, 561-567
9000919 CIFAl2 O5 SiP n n m7.7599; 7.8735; 5.544
90; 90; 90
338.725Ralph, R. L.; Finger, L. W.; Hazen, R. M.; Ghose, S.
Compressibility and crystal structure of andalusite at high pressure 12 kbar continuous-scan
American Mineralogist, 1984, 69, 513-519
9000920 CIFAl2 O5 SiP n n m7.76; 7.873; 5.544
90; 90; 90
338.708Ralph, R. L.; Finger, L. W.; Hazen, R. M.; Ghose, S.
Compressibility and crystal structure of andalusite at high pressure 12 kbar step-scan
American Mineralogist, 1984, 69, 513-519
9000921 CIFAl2 O5 SiP n n m7.7382; 7.8571; 5.5338
90; 90; 90
336.454Ralph, R. L.; Finger, L. W.; Hazen, R. M.; Ghose, S.
Compressibility and crystal structure of andalusite at high pressure 25 kbar step-scan
American Mineralogist, 1984, 69, 513-519
9000922 CIFAl2 O5 SiP n n m7.7049; 7.8375; 5.5262
90; 90; 90
333.711Ralph, R. L.; Finger, L. W.; Hazen, R. M.; Ghose, S.
Compressibility and crystal structure of andalusite at high pressure 37 kbar continuous scan
American Mineralogist, 1984, 69, 513-519
9001090 CIFBi11.536 Cu1.3 Fe0.7 Pb27.684 S57 Sb6.78P n n m34.221; 37.933; 4.063
90; 90; 90
5274.2Armbruster, T.; Hummel, W.
(Sb,Bi,Pb) ordering in sulfosalts: Crystal-structure refinement of a Bi-rich izoklakeite
American Mineralogist, 1987, 72, 821-831
9001445 CIFH4 Mg10 O18 Si3P n n m5.0894; 13.968; 8.6956
90; 90; 90
618.159Pacalo, R. E. G.; Parise, J. B.
Crystal structure of superhydrous B, a hydrous magnesium silicate synthesized at 1400 C and 20 GPa
American Mineralogist, 1992, 77, 681-684
9001847 CIFF4 Mg10 O14 Si3P n n m5.05; 13.969; 8.64
90; 90; 90
609.495Hazen, R. M.; Yang, H.; Prewitt, C. T.; Gasparik, T.
Crystal chemistry of superfluorous phase B (Mg10Si3O14F4): Implications for the role of fluorine in the mantle
American Mineralogist, 1997, 82, 647-650
9003990 CIFAl2 O5 SiP n n m7.793; 7.89734; 5.55583
90; 90; 90
341.928Burt, J. B.; Ross, N. L.; Angel, R. J.; Koch, M.
Equations of state and structures of andalusite to 9.8 GPa and sillimanite to 8.5 GPa Sample: P = .0001 GPa
American Mineralogist, 2006, 91, 319-326
9003991 CIFAl2 O5 SiP n n m7.7568; 7.87268; 5.54488
90; 90; 90
338.608Burt, J. B.; Ross, N. L.; Angel, R. J.; Koch, M.
Equations of state and structures of andalusite to 9.8 GPa and sillimanite to 8.5 GPa Sample: P = 1.474 GPa
American Mineralogist, 2006, 91, 319-326
9003992 CIFAl2 O5 SiP n n m7.732; 7.85659; 5.53642
90; 90; 90
336.322Burt, J. B.; Ross, N. L.; Angel, R. J.; Koch, M.
Equations of state and structures of andalusite to 9.8 GPa and sillimanite to 8.5 GPa Sample: P = 2.512 GPa
American Mineralogist, 2006, 91, 319-326
9003993 CIFAl2 O5 SiP n n m7.7186; 7.8467; 5.5329
90; 90; 90
335.103Burt, J. B.; Ross, N. L.; Angel, R. J.; Koch, M.
Equations of state and structures of andalusite to 9.8 GPa and sillimanite to 8.5 GPa Sample: P = 3.129 GPa
American Mineralogist, 2006, 91, 319-326
9003994 CIFAl2 O5 SiP n n m7.7014; 7.8354; 5.52629
90; 90; 90
333.476Burt, J. B.; Ross, N. L.; Angel, R. J.; Koch, M.
Equations of state and structures of andalusite to 9.8 GPa and sillimanite to 8.5 GPa Sample: P = 3.932 GPa
American Mineralogist, 2006, 91, 319-326
9003995 CIFAl2 O5 SiP n n m7.6704; 7.81452; 5.51589
90; 90; 90
330.625Burt, J. B.; Ross, N. L.; Angel, R. J.; Koch, M.
Equations of state and structures of andalusite to 9.8 GPa and sillimanite to 8.5 GPa Sample: P = 5.441 GPa
American Mineralogist, 2006, 91, 319-326
9003996 CIFAl2 O5 SiP n n m7.6313; 7.78625; 5.50175
90; 90; 90
326.91Burt, J. B.; Ross, N. L.; Angel, R. J.; Koch, M.
Equations of state and structures of andalusite to 9.8 GPa and sillimanite to 8.5 GPa Sample: P = 7.565 GPa
American Mineralogist, 2006, 91, 319-326
9003997 CIFAl2 O5 SiP n n m7.5922; 7.76; 5.4872
90; 90; 90
323.281Burt, J. B.; Ross, N. L.; Angel, R. J.; Koch, M.
Equations of state and structures of andalusite to 9.8 GPa and sillimanite to 8.5 GPa Sample: P = 9.828 GPa
American Mineralogist, 2006, 91, 319-326
9004101 CIFAs H O5 Zn2P n n m8.304; 8.53; 6.047
90; 90; 90
428.328Hawthorne, F. C.
A refinement of the crystal structure of adamite
The Canadian Mineralogist, 1976, 14, 143-148
9004131 CIFCu2 H O5 PP n n m8.062; 8.384; 5.881
90; 90; 90
397.507Cordsen, A.
A crystal-structure refinement of libethenite
The Canadian Mineralogist, 1978, 16, 153-157
9004134 CIFB8 Fe1.76 Mg11.384 Mn10.446 O40P n n m18.357; 12.591; 6.068
90; 90; 90
1402.52Takeuchi, Y.; Haga, N.; Kato, T.; Miura, Y.
Orthopinakiolite, Me2.95O2[BO3]: its crystal structure and relationship to pinakiolite, Me2.90O2[BO3] Note: z-coordinate of O9 changed. y-coordinate of M7* changed.
The Canadian Mineralogist, 1978, 16, 475-485
9004333 CIFC12 H34 Ca6 Na3 O61 U4P n n m18.15; 16.866; 18.436
90; 90; 90
5643.59Vochten, R.; Haverbeke, L. V.; Springel, K. V.
The structure and physicochemical characteristics of a synthetic phase compositionally intermediate between liebigite and andersonite
The Canadian Mineralogist, 1994, 32, 553-561
9004387 CIFAs Cu2 O5P n n m8.5894; 8.2076; 5.9286
90; 90; 90
417.957Burns, P. C.; Hawthorne, F. C.
Rietveld refinement of the crystal structure of olivenite: A twinned monoclinic structure
The Canadian Mineralogist, 1995, 33, 885-888
9004486 CIFH12.62 K2.04 O28.84 U6P n n m14.8591; 7.1747; 12.1871
90; 90; 90
1299.26Burns, P. C.
The structure of compreignacite, K2((UO2)3O2(OH)3)2(H2O)7
The Canadian Mineralogist, 1998, 36, 1061-1067
9004488 CIFAl0.28 B16 Mg10.44 Mn41.28 O80 Sb3P n n m37.654; 12.615; 6.2472
90; 90; 90
2967.45Cooper, M. A.; Hawthorne, F. C.
The crystal structure of blatterite, Sb3(Mn,Fe)9(Mn,Mg)35(BO3)16O32, and structural hierarchy in Mn-bearing zigzag borates
The Canadian Mineralogist, 1998, 36, 1171-1193
9006858 CIFGe O2P n n m4.2841; 4.2098; 2.8089
90; 90; 90
50.659Haines, J.; Leger, J. M.; Chateau, C.; Pereira, A. S.
Structural evolution of rutile-type and CaCl2-type germanium dioxide at high pressure Sample: CaCl2-type, post-argutite, P = 28 GPa
Physics and Chemistry of Minerals, 2000, 27, 575-582
9006859 CIFGe O2P n n m4.2852; 4.1959; 2.8062
90; 90; 90
50.456Haines, J.; Leger, J. M.; Chateau, C.; Pereira, A. S.
Structural evolution of rutile-type and CaCl2-type germanium dioxide at high pressure Sample: CaCl2-type, post-argutite, P = 29 GPa
Physics and Chemistry of Minerals, 2000, 27, 575-582
9006860 CIFGe O2P n n m4.2866; 4.1742; 2.7995
90; 90; 90
50.092Haines, J.; Leger, J. M.; Chateau, C.; Pereira, A. S.
Structural evolution of rutile-type and CaCl2-type germanium dioxide at high pressure Sample: CaCl2-type, post-argutite, P = 32 GPa
Physics and Chemistry of Minerals, 2000, 27, 575-582
9006861 CIFGe O2P n n m4.2834; 4.1508; 2.7941
90; 90; 90
49.678Haines, J.; Leger, J. M.; Chateau, C.; Pereira, A. S.
Structural evolution of rutile-type and CaCl2-type germanium dioxide at high pressure Sample: CaCl2-type, post-argutite, P = 35 GPa Note: O y-coordinate altered from the reported value
Physics and Chemistry of Minerals, 2000, 27, 575-582
9006862 CIFGe O2P n n m4.2814; 4.1424; 2.7919
90; 90; 90
49.515Haines, J.; Leger, J. M.; Chateau, C.; Pereira, A. S.
Structural evolution of rutile-type and CaCl2-type germanium dioxide at high pressure Sample: CaCl2-type, post-argutite, P = 36 GPa
Physics and Chemistry of Minerals, 2000, 27, 575-582
9007380 CIFD3.2 H0.8 Mg8.2 Ni1.8 O18 Si3P n n m13.991; 5.097; 8.715
90; 90; 90
621.485Koch-Muller M; Dera, P.; Fei, Y.; Hellwig, H.; Liu, Z.; Van Orman, J.; Wirth, R.
Polymorphic phase transition in Superhydrous Phase B Sample: JIM252
Physics and Chemistry of Minerals, 2005, 32, 349-361
9008386 CIFB12 Mg20.58 Mn15.42 O60P n n m27.585; 12.561; 6.027
90; 90; 90
2088.33Norrestam, R.; Bovin, J.-O.
The crystal structure of takeuchiite, Mg1.71Mn1.29BO5: A combined single crystal X-ray and HRTEM study
Zeitschrift fur Kristallographie, 1987, 181, 135-149
9009084 CIFCa Cl2P n n m6.24; 6.43; 4.2
90; 90; 90
168.517Wyckoff, R. W. G.
Second edition. Interscience Publishers, New York, New York Note: distorted rutile structure
Crystal Structures, 1963, 1, 239-444
9009085 CIFCl2 CrP n n m5.974; 6.624; 3.488
90; 90; 90
138.026Wyckoff, R. W. G.
Second edition. Interscience Publishers, New York, New York Note: distorted rutile structure
Crystal Structures, 1963, 1, 239-444
9009403 CIFCu3 H4 Mo O8P n n m12.559; 8.518; 6.072
90; 90; 90
649.568Stolz, J.; Armbruster, T.
X-ray single-crystal structure refinement of szenicsite, Cu3MoO4(OH)4, and its relation to the structure of antlerite, Cu3SO4(OH)4
Neues Jahrbuch fur Mineralogie, Monatshefte, 1998, 1998, 278-288
9009410 CIFAs1.94 Co0.03 Fe0.61 Ni0.36 S0.02 Sb0.04P n n m5.243; 5.978; 2.9783
90; 90; 90
93.348Ondrus, P.; Vavrin, I.; Skala, R.; Veselovsky, F.
Low-temperature Ni-rich lollingite from Haje, Pibram, Czech Republic. Rietveld crystal structure refinement
Neues Jahrbuch fur Mineralogie, Monatshefte, 2001, 2001, 169-185
9009411 CIFAs2 FeP n n m5.2684; 5.9631; 2.9007
90; 90; 90
91.128Ondrus, P.; Vavrin, I.; Skala, R.; Veselovsky, F.
Low-temperature Ni-rich lollingite from Haje, Pibram, Czech Republic. Rietveld crystal structure refinement
Neues Jahrbuch fur Mineralogie, Monatshefte, 2001, 2001, 169-185
9009853 CIFCu Se2P n n m5.005; 6.182; 3.74
90; 90; 90
115.719Heyding, R. D.; Murray, R. M.
Crystal structures of Cu1.8Se, Cu3Se2, alpha- and gamma-CuSe, CuSe2, and CuSe2II Note: low-pressure polymorph, marcasite structure
Canadian Journal of Chemistry, 1976, 54, 841-848
9009913 CIFP2 RuP n n m5.1169; 5.8915; 2.8709
90; 90; 90
86.547Kjekshus, A.; Rakke, T.; Andresen, A. F.
Compounds with the marcasite type crystal structure. XII. Structural data for RuP2, RuAs2, RuSb2, OsP2, OsAs2, and OsSb2
Acta Chemica Scandinavica A, 1977, 31, 253-259
9009914 CIFAs2 RuP n n m5.4279; 6.1834; 2.9685
90; 90; 90
99.631RuAs2; Kjekshus A; Rakke T; Andresen A F
Compounds with the marcasite type crystal structure. XII. Structural data for RuP2, RuAs2, RuSb2, OsP2, OsAs2, and OsSb2 Locality: synthetic
Acta Chemica Scandinavica A, 1977, 31, 253-259
9009915 CIFRu Sb2P n n m5.9514; 6.6743; 3.179
90; 90; 90
126.274Kjekshus, A.; Rakke, T.; Andresen, A. F.
Compounds with the marcasite type crystal structure. XII. Structural data for RuP2, RuAs2, RuSb2, OsP2, OsAs2, and OsSb2
Acta Chemica Scandinavica A, 1977, 31, 253-259
9009916 CIFOs P2P n n m5.1012; 5.9022; 2.9183
90; 90; 90
87.865Kjekshus, A.; Rakke, T.; Andresen, A. F.
Compounds with the marcasite type crystal structure. XII. Structural data for RuP2, RuAs2, RuSb2, OsP2, OsAs2, and OsSb2
Acta Chemica Scandinavica A, 1977, 31, 253-259
9009917 CIFAs2 OsP n n m5.4115; 6.19; 3.0127
90; 90; 90
100.917OsAs2; Kjekshus A; Rakke T; Andresen A F
Compounds with the marcasite type crystal structure. XII. Structural data for RuP2, RuAs2, RuSb2, OsP2, OsAs2, and OsSb2 Locality: synthetic
Acta Chemica Scandinavica A, 1977, 31, 253-259
9009918 CIFOs Sb2P n n m5.9411; 6.6873; 3.2109
90; 90; 90
127.569Kjekshus, A.; Rakke, T.; Andresen, A. F.
Compounds with the marcasite type crystal structure. XII. Structural data for RuP2, RuAs2, RuSb2, OsP2, OsAs2, and OsSb2
Acta Chemica Scandinavica A, 1977, 31, 253-259
9010399 CIFCa3 H2 O9 Si2 Zr0.5P n n m5.666; 18.844; 3.728
90; 90; 90
398.039Kadiyski, M.; Armbruster, T.; Galuskin, E. V.; Pertsev, N. N.; Zadov, A. E.; Galuskina, I. O.; Wrzalik, R.; Dzierzanowski, P.; Kislov, E. V.
The modular structure of dovyrenite, Ca6Zr[Si2O7]2(OH)4: alternate stacking of tobermorite and rosenbuschite-like units Locality: skarndolomite xenoliths, Dovyren massif, Russia
American Mineralogist, 2008, 93, 456-462
9011163 CIFCu H12 N6 O6P n n m10.84; 23.693; 6.902
90; 90; 90
1772.66Morosin, B.
The crystal structure of copper(II) tetraammine nitrate
Acta Crystallographica, Section B, 1976, 32, 1237-1240
9011188 CIFAs Cu0.86 H O5 Zn1.14P n n m8.5; 8.52; 5.99
90; 90; 90
433.796Toman, K.
Ordering in olivenite-adamite solid solutions
Acta Crystallographica, Section B, 1978, 34, 715-721
9011400 CIFAs2 Co0.61 Fe0.17 Ni0.22P n n m5.0669; 5.8739; 3.1346
90; 90; 90
93.293Yang, H.; Downs, R. T.; Eichler, C.
Safflorite, (Co,Ni,Fe)As2, isomorphous with marcasite
Acta Crystallographica, Section E, 2008, 64, i62-i62
9011583 CIFBi7.89 Cu0.888 Fe1.112 Pb12 S35 Sb6.11P n n m22.575; 34.104; 4.038
90; 90; 90
3108.85Miehe, G.
Crystal structure of kobellite
Nature Physical Science, 1971, 231, 133-134
9012125 CIFFe Se2P n n m4.804; 5.784; 3.586
90; 90; 90
99.642Pickardt, J.; Reuter, B.; Riedel, E.; Sochtig, J.
On the formation of FeSe2 single crystals by chemical transport reactions
Journal of Solid State Chemistry, 1975, 15, 366-368
9012130 CIFCr D O2P n n m4.873; 4.332; 2.963
90; 90; 90
62.548Christensen, N.; Hansen, P.; Lehmann, M. S.
Isotope effects in the bonds of beta-CrOOH and beta-CrOOD Locality: synthetic
Journal of Solid State Chemistry, 1976, 19, 299-304
9012131 CIFCr H O2P n n m4.862; 4.298; 2.995
90; 90; 90
62.586Christensen, N.; Hansen, P.; Lehmann, M. S.
Isotope effects in the bonds of beta-CrOOH and beta-CrOOD
Journal of Solid State Chemistry, 1976, 19, 299-304
9012340 CIFAs2 FeP n n m5.3001; 5.9838; 2.8821
90; 90; 90
91.405Lutz, H. D.; Jung, M.; Waschenbach, G.
Kristallstrukturen des lollingits FeAs2 und des pyrits RuTe2
Zeitschrift fur Anorganische und Allgemeine Chemie, 1987, 554, 87-91
9012539 CIFFe Sb2P n n m5.8328; 6.5376; 3.1973
90; 90; 90
121.921Holseth, H.; Kjekshus, A.
Compounds with the marcasite type crystal structure IV. The crystal structure of FeSb2 Note: Powder X-ray diffractometer with strip charts
Acta Chemica Scandinavica, 1969, 23, 3043-3050
9012541 CIFFe Sb2P n n m5.8328; 6.5376; 3.1973
90; 90; 90
121.921Holseth, H.; Kjekshus, A.
Compounds with the marcasite type crystal structure IV. The crystal structure of FeSb2 Note: Powder X-ray counted by step-scanning
Acta Chemica Scandinavica, 1969, 23, 3043-3050
9012543 CIFFe Sb2P n n m5.8328; 6.5376; 3.1973
90; 90; 90
121.921Holseth, H.; Kjekshus, A.
Compounds with the marcasite type crystal structure IV. The crystal structure of FeSb2 Note: Powder neutron counted by step-scanning
Acta Chemica Scandinavica, 1969, 23, 3043-3050
9012544 CIFFe Sb2P n n m5.8328; 6.5376; 3.1973
90; 90; 90
121.921Holseth, H.; Kjekshus, A.
Compounds with the marcasite type crystal structure IV. The crystal structure of FeSb2 Note: Single crystal X-ray from integrated Weissenberg film
Acta Chemica Scandinavica, 1969, 23, 3043-3050
9012550 CIFAs2 FeP n n m5.3012; 5.9858; 2.8822
90; 90; 90
91.458Kjekshus, A.; Rakke, T.; Andresen, A.
Compounds of the marcasite type crystal structure. IX. Structural data for FeAs2, FeSe2, NiAs2, NiSb2, and CuSe2
Acta Chemica Scandinavica A, 1974, 28, 996-1000
9012551 CIFFe Se2P n n m4.8002; 5.7823; 3.5834
90; 90; 90
99.462Kjekshus, A.; Rakke, T.; Andresen, A.
Compounds of the marcasite type crystal structure. IX. Structural data for FeAs2, FeSe2, NiAs2, NiSb2, and CuSe2
Acta Chemica Scandinavica A, 1974, 28, 996-1000
9012552 CIFAs2 NiP n n m4.7582; 5.7949; 3.544
90; 90; 90
97.72Kjekshus, A.; Rakke, T.; Andresen, A.
Compounds of the marcasite type crystal structure. IX. Structural data for FeAs2, FeSe2, NiAs2, NiSb2, and CuSe2
Acta Chemica Scandinavica A, 1974, 28, 996-1000
9012553 CIFNi Sb2P n n m5.1823; 6.3168; 3.8403
90; 90; 90
125.714Kjekshus, A.; Rakke, T.; Andresen, A.
Compounds of the marcasite type crystal structure. IX. Structural data for FeAs2, FeSe2, NiAs2, NiSb2, and CuSe2
Acta Chemica Scandinavica A, 1974, 28, 996-1000
9012554 CIFCu Se2P n n m5.0226; 6.1957; 3.7468
90; 90; 90
116.595Kjekshus, A.; Rakke, T.; Andresen, A.
Compounds of the marcasite type crystal structure. IX. Structural data for FeAs2, FeSe2, NiAs2, NiSb2, and CuSe2
Acta Chemica Scandinavica A, 1974, 28, 996-1000
9012565 CIFAs2 Cr0.79 Fe0.21P n n m5.4174; 6.2433; 2.9803
90; 90; 90
100.801Kjekshus, A.; Peterzens, P. G.; Rakke, T.; Andresen, A. F.
Compounds with the marcasite type crystal structure. XIII. Structural and magnetic properties of CrtFe1-tAs2, CrtFe1-tSb2, Fe1-tNitAs2 and Fe1-tNitSb2
Acta Chemica Scandinavica A, 1979, 33, 469-480
9012566 CIFAs2 Fe0.63 Ni0.37P n n m5.3971; 6.1893; 2.9539
90; 90; 90
98.673Kjekshus, A.; Peterzens, P. G.; Rakke, T.; Andresen, A. F.
Compounds with the marcasite type crystal structure. XIII. Structural and magnetic properties of CrtFe1-tAs2, CrtFe1-tSb2, Fe1-tNitAs2 and Fe1-tNitSb2
Acta Chemica Scandinavica A, 1979, 33, 469-480
9012567 CIFAs2 Cr0.47 Fe0.53P n n m5.3771; 6.1368; 2.9309
90; 90; 90
96.714Kjekshus, A.; Peterzens, P. G.; Rakke, T.; Andresen, A. F.
Compounds with the marcasite type crystal structure. XIII. Structural and magnetic properties of CrtFe1-tAs2, CrtFe1-tSb2, Fe1-tNitAs2 and Fe1-tNitSb2 Sample: Fe.53Cr.47As2
Acta Chemica Scandinavica A, 1979, 33, 469-480
9012568 CIFAs2 Cr0.32 Fe0.68P n n m5.3544; 6.0853; 2.9112
90; 90; 90
94.856Kjekshus, A.; Peterzens, P. G.; Rakke, T.; Andresen, A. F.
Compounds with the marcasite type crystal structure. XIII. Structural and magnetic properties of CrtFe1-tAs2, CrtFe1-tSb2, Fe1-tNitAs2 and Fe1-tNitSb2 Sample: Fe.68Cr.32As2
Acta Chemica Scandinavica A, 1979, 33, 469-480
9012569 CIFAs2 FeP n n m5.3013; 5.9859; 2.8822
90; 90; 90
91.461Kjekshus, A.; Peterzens, P. G.; Rakke, T.; Andresen, A. F.
Compounds with the marcasite type crystal structure. XIII. Structural and magnetic properties of CrtFe1-tAs2, CrtFe1-tSb2, Fe1-tNitAs2 and Fe1-tNitSb2 Sample: FeAs2
Acta Chemica Scandinavica A, 1979, 33, 469-480
9012570 CIFAs2 Fe0.75 Ni0.25P n n m5.2309; 5.9555; 2.9693
90; 90; 90
92.501Kjekshus, A.; Peterzens, P. G.; Rakke, T.; Andresen, A. F.
Compounds with the marcasite type crystal structure. XIII. Structural and magnetic properties of CrtFe1-tAs2, CrtFe1-tSb2, Fe1-tNitAs2 and Fe1-tNitSb2 Sample: Fe.75Ni.25As2
Acta Chemica Scandinavica A, 1979, 33, 469-480
9012571 CIFAs2 Fe0.5 Ni0.5P n n m5.1377; 5.9205; 3.1077
90; 90; 90
94.529Kjekshus, A.; Peterzens, P. G.; Rakke, T.; Andresen, A. F.
Compounds with the marcasite type crystal structure. XIII. Structural and magnetic properties of CrtFe1-tAs2, CrtFe1-tSb2, Fe1-tNitAs2 and Fe1-tNitSb2 Sample: Fe.5Ni.5As2
Acta Chemica Scandinavica A, 1979, 33, 469-480
9012572 CIFAs2 NiP n n m4.7583; 5.7954; 3.5449
90; 90; 90
97.755Kjekshus, A.; Peterzens, P. G.; Rakke, T.; Andresen, A. F.
Compounds with the marcasite type crystal structure. XIII. Structural and magnetic properties of CrtFe1-tAs2, CrtFe1-tSb2, Fe1-tNitAs2 and Fe1-tNitSb2 Sample: NiAs2
Acta Chemica Scandinavica A, 1979, 33, 469-480
9012573 CIFCr Sb2P n n m6.0275; 6.8738; 3.2715
90; 90; 90
135.544Kjekshus, A.; Peterzens, P. G.; Rakke, T.; Andresen, A. F.
Compounds with the marcasite type crystal structure. XIII. Structural and magnetic properties of CrtFe1-tAs2, CrtFe1-tSb2, Fe1-tNitAs2 and Fe1-tNitSb2
Acta Chemica Scandinavica A, 1979, 33, 469-480
9012574 CIFCr0.93 Fe0.07 Sb2P n n m6.0205; 6.8491; 3.2628
90; 90; 90
134.542Kjekshus, A.; Peterzens, P. G.; Rakke, T.; Andresen, A. F.
Compounds with the marcasite type crystal structure. XIII. Structural and magnetic properties of CrtFe1-tAs2, CrtFe1-tSb2, Fe1-tNitAs2 and Fe1-tNitSb2
Acta Chemica Scandinavica A, 1979, 33, 469-480
9012575 CIFCr0.88 Fe0.12 Sb2P n n m6.0156; 6.8341; 3.2569
90; 90; 90
133.895Kjekshus, A.; Peterzens, P. G.; Rakke, T.; Andresen, A. F.
Compounds with the marcasite type crystal structure. XIII. Structural and magnetic properties of CrtFe1-tAs2, CrtFe1-tSb2, Fe1-tNitAs2 and Fe1-tNitSb2
Acta Chemica Scandinavica A, 1979, 33, 469-480
9012576 CIFCr0.72 Fe0.28 Sb2P n n m5.9862; 6.781; 3.237
90; 90; 90
131.398Kjekshus, A.; Peterzens, P. G.; Rakke, T.; Andresen, A. F.
Compounds with the marcasite type crystal structure. XIII. Structural and magnetic properties of CrtFe1-tAs2, CrtFe1-tSb2, Fe1-tNitAs2 and Fe1-tNitSb2
Acta Chemica Scandinavica A, 1979, 33, 469-480
9012577 CIFCr0.6 Fe0.4 Sb2P n n m5.9632; 6.7391; 3.2233
90; 90; 90
129.533Kjekshus, A.; Peterzens, P. G.; Rakke, T.; Andresen, A. F.
Compounds with the marcasite type crystal structure. XIII. Structural and magnetic properties of CrtFe1-tAs2, CrtFe1-tSb2, Fe1-tNitAs2 and Fe1-tNitSb2
Acta Chemica Scandinavica A, 1979, 33, 469-480
9012578 CIFCr0.45 Fe0.55 Sb2P n n m5.9378; 6.886; 3.2147
90; 90; 90
131.442Kjekshus, A.; Peterzens, P. G.; Rakke, T.; Andresen, A. F.
Compounds with the marcasite type crystal structure. XIII. Structural and magnetic properties of CrtFe1-tAs2, CrtFe1-tSb2, Fe1-tNitAs2 and Fe1-tNitSb2 Sample: Fe.55Cr.45Sb2
Acta Chemica Scandinavica A, 1979, 33, 469-480
9012579 CIFCr0.21 Fe0.79 Sb2P n n m5.8833; 6.6072; 3.2004
90; 90; 90
124.406Kjekshus, A.; Peterzens, P. G.; Rakke, T.; Andresen, A. F.
Compounds with the marcasite type crystal structure. XIII. Structural and magnetic properties of CrtFe1-tAs2, CrtFe1-tSb2, Fe1-tNitAs2 and Fe1-tNitSb2 Sample: Fe.79Cr.21Sb2
Acta Chemica Scandinavica A, 1979, 33, 469-480
9012580 CIFFe Sb2P n n m5.8328; 6.7356; 3.1973
90; 90; 90
125.614Kjekshus, A.; Peterzens, P. G.; Rakke, T.; Andresen, A. F.
Compounds with the marcasite type crystal structure. XIII. Structural and magnetic properties of CrtFe1-tAs2, CrtFe1-tSb2, Fe1-tNitAs2 and Fe1-tNitSb2 Sample: FeSb2
Acta Chemica Scandinavica A, 1979, 33, 469-480
9012581 CIFFe0.75 Ni0.25 Sb2P n n m5.7535; 6.4928; 3.2681
90; 90; 90
122.084Kjekshus, A.; Peterzens, P. G.; Rakke, T.; Andresen, A. F.
Compounds with the marcasite type crystal structure. XIII. Structural and magnetic properties of CrtFe1-tAs2, CrtFe1-tSb2, Fe1-tNitAs2 and Fe1-tNitSb2 Sample: Fe.75Ni.25Sb2
Acta Chemica Scandinavica A, 1979, 33, 469-480
9012582 CIFFe0.5 Ni0.5 Sb2P n n m5.6417; 6.4402; 3.3855
90; 90; 90
123.008Kjekshus, A.; Peterzens, P. G.; Rakke, T.; Andresen, A. F.
Compounds with the marcasite type crystal structure. XIII. Structural and magnetic properties of CrtFe1-tAs2, CrtFe1-tSb2, Fe1-tNitAs2 and Fe1-tNitSb2 Sample: Fe.5Ni.5Sb2
Acta Chemica Scandinavica A, 1979, 33, 469-480
9012583 CIFNi Sb2P n n m5.1837; 6.3184; 3.4808
90; 90; 90
114.006Kjekshus, A.; Peterzens, P. G.; Rakke, T.; Andresen, A. F.
Compounds with the marcasite type crystal structure. XIII. Structural and magnetic properties of CrtFe1-tAs2, CrtFe1-tSb2, Fe1-tNitAs2 and Fe1-tNitSb2 Sample: NiSb2
Acta Chemica Scandinavica A, 1979, 33, 469-480
9013067 CIFFe S2P n n m4.4446; 5.4246; 3.3864
90; 90; 90
81.647Rieder, M.; Crelling, J. C.; Sustai, O.; Drabek, M.; Weiss, Z.; Klementova, M.
Arsenic in iron disulfides in a brown coal from the North Bohemian Basin, Czech Republic Sample: As-free marcasite
International Journal of Coal Geology, 2007, 71, 115-121
9013068 CIFAs0.4 Fe S1.6P n n m4.449; 5.432; 3.391
90; 90; 90
81.95Rieder, M.; Crelling, J. C.; Sustai, O.; Drabek, M.; Weiss, Z.; Klementova, M.
Arsenic in iron disulfides in a brown coal from the North Bohemian Basin, Czech Republic Sample: Natural As-marcasite
International Journal of Coal Geology, 2007, 71, 115-121
9013419 CIFBP n n m5.0576; 5.6245; 6.9884
90; 90; 90
198.795Zarechnaya, E. Y.; Dubrovinsky, L.; Dubrovinskaia, N.; Filinchuk, Y.; Chernyshov, D.; Dmitriev, V.; Miyajima, N.; El Goresy, A.; Braun, H. F.; Van Smaalen, S.; Kantor, I.; Kantor, A.; Prakapenka, V.; Hanfland, M.; Mikhaylushkin, A. S.; Abrikosov, I. A.; Simak, S. I.
Superhard semiconducting optically transparent high pressure phase of boron Note: crystal quenched from 20 GPa, 1700 K
Physical Review Letters, 2009, 102, 185501-1185501-4
9013942 CIFCu3 H4 Mo O8P n n m8.5201; 12.545; 6.0794
90; 90; 90
649.795Burns, P. C.
The crystal structure of szenicsite, Cu3MoO4(OH)4
Mineralogical Magazine, 1998, 62, 461-469
9013999 CIFAs0.02 Cu0.94 H O5 P0.98 Zn1.06P n n m8.323; 8.251; 5.861
90; 90; 90
402.493Williams, P. A.; Leverett, P.; Birch, W. D.; Hibbs, D. E.; Kilitsch, U.; Mihajlovic, T.
Zinc-rich zincolibethenite from Broken Hill, New South Wales Note: z-coordinate of O3 altered by communication with authors, April 2010
Australian Journal of Mineralogy, 2006, 12, 3-7
9014026 CIFCl10 Cu6.15 K0.62 O8 Pb1.45 Se2 ZnP n n m9.132; 19.415; 13.213
90; 90; 90
2342.64Shuvalov, R. R.; Vergasova, L. P.; Semenova, T. F.; Filatov, S. K.; Krivovichev, S. V.; Siidra, O. I.; Rudashevsky, N. S.
Prewittite, KPb1.5Cu6Zn(SeO3)2O2Cl10, a new mineral from Tolbachik fumaroles, Kamchatka peninsula, Russia: Description and crystal structure
American Mineralogist, 2013, 98, 463-469
9014569 CIFC24 H48 Ca12 K7.11 O112 U8P n n m17.015; 18.048; 18.394
90; 90; 90
5648.55Hughes Kubatko, K. A.; Burns, P. C.
The crystal structure of a novel uranyl tricarbonate, K2Ca3[(UO2)(CO3)3]2(H2O)6
The Canadian Mineralogist, 2004, 42, 997-1003
9014615 CIFCr H2 O2P n n m4.8691; 4.3184; 2.9594
90; 90; 90
62.226Jahn, S.; Wunder, B.; Koch-Muller M; Tarrieu, L.; Pohle, M.; Watenphul, A.; Taran, M. N.
Pressure-induced hydrogen bond symmetrisation in guyanaite, B-CrOOH: evidence from spectroscopy and ab initio simulations Sample: Run #630
European Journal of Mineralogy, 2012, 24, 839-850
9015092 CIFAs2 Fe0.37 Ni0.63P n n m5.3971; 6.1893; 2.9539
90; 90; 90
98.673Kjekshus, A.; Peterzens, P. G.; Rakke, T.; Andresen, A. F.
Compounds with the marcasite type crystal structure. XIII. Structural and magnetic properties of CrtFe1-tAs2, CrtFe1-tSb2, Fe1-tNitAs2 and Fe1-tNitSb2
Acta Chemica Scandinavica A, 1979, 33, 469-480
9015195 CIFAs Cu1.45 Fe0.55 O5P n n m8.6235; 8.2757; 5.9501
90; 90; 90
424.632Mills, S. J.; Kampf, A. R.; Poirier, G.; Raudsepp, M.; Steele, I. M.
Auriacusite, Fe3+Cu2+AsO4O, the first M3+ member of the olivenite group, from the Black Pine mine, Montana, USA
Mineralogy and Petrology, 2010, 99, 113-120
9015967 CIFCr H2 O2P n n m4.8623; 4.2972; 2.9567
90; 90; 90
61.778Jahn, S.; Wunder, B.; Koch-Muller M; Tarrieu, L.; Pohle, M.; Watenphul, A.; Taran, M. N.
Pressure-induced hydrogen bond symmetrisation in guyanaite, B-CrOOH: evidence from spectroscopy and ab initio simulations Sample: Run LT9
European Journal of Mineralogy, 2012, 24, 839-850
9017079 CIFH Mg0.5 O2 Si0.5P n n m4.733; 4.325; 2.842
90; 90; 90
58.176Bindi, 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
9017428 CIFFe Se2P n n m4.804; 5.781; 3.5817
90; 90; 90
99.471Lavina, B.; Downs, R. T.; Sinogeikin, S.
The structure of ferroselite, FeSe2, at pressures up to 46 GPa and temperatures down to 50 K: A single-crystal micro-diffraction analysis Note: P = 0.0 GPa
Crystals, 2018, 8
9017429 CIFFe Se2P n n m4.771; 5.756; 3.5663
90; 90; 90
97.937Lavina, B.; Downs, R. T.; Sinogeikin, S.
The structure of ferroselite, FeSe2, at pressures up to 46 GPa and temperatures down to 50 K: A single-crystal micro-diffraction analysis Note: P = 1.7 GPa
Crystals, 2018, 8
9017430 CIFFe Se2P n n m4.751; 5.729; 3.5467
90; 90; 90
96.536Lavina, B.; Downs, R. T.; Sinogeikin, S.
The structure of ferroselite, FeSe2, at pressures up to 46 GPa and temperatures down to 50 K: A single-crystal micro-diffraction analysis Note: P = 3.83 GPa
Crystals, 2018, 8
9017431 CIFFe Se2P n n m4.698; 5.667; 3.5088
90; 90; 90
93.417Lavina, B.; Downs, R. T.; Sinogeikin, S.
The structure of ferroselite, FeSe2, at pressures up to 46 GPa and temperatures down to 50 K: A single-crystal micro-diffraction analysis Note: P = 8.1 GPa
Crystals, 2018, 8
9017432 CIFFe Se2P n n m4.603; 5.581; 3.4492
90; 90; 90
88.608Lavina, B.; Downs, R. T.; Sinogeikin, S.
The structure of ferroselite, FeSe2, at pressures up to 46 GPa and temperatures down to 50 K: A single-crystal micro-diffraction analysis Note: P = 17.3 GPa
Crystals, 2018, 8
9017433 CIFFe Se2P n n m4.555; 5.524; 3.409
90; 90; 90
85.777Lavina, B.; Downs, R. T.; Sinogeikin, S.
The structure of ferroselite, FeSe2, at pressures up to 46 GPa and temperatures down to 50 K: A single-crystal micro-diffraction analysis Note: P = 24.4 GPa
Crystals, 2018, 8
9017434 CIFFe Se2P n n m4.488; 5.471; 3.3734
90; 90; 90
82.83Lavina, B.; Downs, R. T.; Sinogeikin, S.
The structure of ferroselite, FeSe2, at pressures up to 46 GPa and temperatures down to 50 K: A single-crystal micro-diffraction analysis Note: P = 32 GPa
Crystals, 2018, 8
9017435 CIFFe Se2P n n m4.404; 5.391; 3.3185
90; 90; 90
78.788Lavina, B.; Downs, R. T.; Sinogeikin, S.
The structure of ferroselite, FeSe2, at pressures up to 46 GPa and temperatures down to 50 K: A single-crystal micro-diffraction analysis Note: P = 46 GPa
Crystals, 2018, 8
9017436 CIFFe Se2P n n m4.7885; 5.7782; 3.5821
90; 90; 90
99.113Lavina, B.; Downs, R. T.; Sinogeikin, S.
The structure of ferroselite, FeSe2, at pressures up to 46 GPa and temperatures down to 50 K: A single-crystal micro-diffraction analysis Note: T = 198.2 K, P = 0.0001 GPa
Crystals, 2018, 8
9017437 CIFFe Se2P n n m4.7893; 5.7775; 3.5795
90; 90; 90
99.045Lavina, B.; Downs, R. T.; Sinogeikin, S.
The structure of ferroselite, FeSe2, at pressures up to 46 GPa and temperatures down to 50 K: A single-crystal micro-diffraction analysis Note: T = 148.4 K, P = 0.0001 GPa
Crystals, 2018, 8
9017438 CIFFe Se2P n n m4.7834; 5.7767; 3.5789
90; 90; 90
98.893Lavina, B.; Downs, R. T.; Sinogeikin, S.
The structure of ferroselite, FeSe2, at pressures up to 46 GPa and temperatures down to 50 K: A single-crystal micro-diffraction analysis Note: T = 50.4 K, P = 0.0001 GPa
Crystals, 2018, 8
9017439 CIFFe Se2P n n m4.751; 5.723; 3.5501
90; 90; 90
96.527Lavina, B.; Downs, R. T.; Sinogeikin, S.
The structure of ferroselite, FeSe2, at pressures up to 46 GPa and temperatures down to 50 K: A single-crystal micro-diffraction analysis Note: T = 197 K, P = 3.68 GPa
Crystals, 2018, 8
9017440 CIFFe Se2P n n m4.7446; 5.772; 3.5512
90; 90; 90
97.253Lavina, B.; Downs, R. T.; Sinogeikin, S.
The structure of ferroselite, FeSe2, at pressures up to 46 GPa and temperatures down to 50 K: A single-crystal micro-diffraction analysis Note: T = 116 K, P = 3.64 GPa
Crystals, 2018, 8
9017591 CIFAl3.28 Cl Cu0.72 H14 O25 Pb4 S0.5 Si4.5P n n m13.969; 14.243; 5.893
90; 90; 90
1172.47Kampf, A. R.; Pluth, J. J.; Chen, Y. S.; Roberts, A. C.; Housley, R. M.
Bobmeyerite, a new mineral from Tiger, Arizona, USA, structurally related to cerchiaraite and ashburtonite
Mineralogical Magazine, 2013, 77, 81-91
9017758 CIFCu0.53 Fe0.47 Se2P n n m4.918; 6.001; 3.57
90; 90; 90
105.361Bindi, L.; Forster, H. J.; Grundmann, G.; Keutsch, F. N.; Stanley, C. J.
Petricekite, CuSe2, a new member of the marcasite group from the Predborice Deposit, Central Bohemia Region, Czech Republic
Minerals, 2016, 6

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