Crystallography Open Database

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9010898 CIFAl0.03 Fe0.15 Mg1.82 O6 Si1.97P b c a18.2513; 8.8274; 5.1929
90; 90; 90
836.636Gatta, G. D.; Rinaldi, R.; Knight, K. S.; Molin, G.; Artioli, G.
High temperature structural and thermoelastic behaviour of mantle orthopyroxene: an in situ neutron powder diffraction study Sample: T = 150 C
Physics and Chemistry of Minerals, 2007, 34, 185-200
9010899 CIFCa D2 O2P -3 m 13.5717; 3.57; 4.8743
90; 90; 120
53.825Xu, H.; Zhao, Y.; Zhang, J.; Hickmott, D. D.; Daemen, L. L.
In situ neutron diffraction study of deuterated portlandite Ca(OD)2 at high pressure and temperature Sample: P = .07 GPa
Physics and Chemistry of Minerals, 2007, 34, 223-232
9010900 CIFCa D2 O2P -3 m 13.5692; 3.5692; 4.8758
90; 90; 120
53.792Xu, H.; Zhao, Y.; Zhang, J.; Hickmott, D. D.; Daemen, L. L.
In situ neutron diffraction study of deuterated portlandite Ca(OD)2 at high pressure and temperature Sample: P = .15 GPa
Physics and Chemistry of Minerals, 2007, 34, 223-232
9010901 CIFCa D2 O2P -3 m 13.5592; 3.5592; 4.8155
90; 90; 120
52.83Xu, H.; Zhao, Y.; Zhang, J.; Hickmott, D. D.; Daemen, L. L.
In situ neutron diffraction study of deuterated portlandite Ca(OD)2 at high pressure and temperature Sample: P = .78 GPa
Physics and Chemistry of Minerals, 2007, 34, 223-232
9010902 CIFCa D2 O2P -3 m 13.5462; 3.5462; 4.7428
90; 90; 120
51.653Xu, H.; Zhao, Y.; Zhang, J.; Hickmott, D. D.; Daemen, L. L.
In situ neutron diffraction study of deuterated portlandite Ca(OD)2 at high pressure and temperature Sample: P = 1.61 GPa
Physics and Chemistry of Minerals, 2007, 34, 223-232
9010903 CIFCa D2 O2P -3 m 13.5384; 3.5384; 4.7084
90; 90; 120
51.053Xu, H.; Zhao, Y.; Zhang, J.; Hickmott, D. D.; Daemen, L. L.
In situ neutron diffraction study of deuterated portlandite Ca(OD)2 at high pressure and temperature Sample: P = 2.08 GPa
Physics and Chemistry of Minerals, 2007, 34, 223-232
9010904 CIFCa D2 O2P -3 m 13.5341; 3.5341; 4.6861
90; 90; 120
50.687Xu, H.; Zhao, Y.; Zhang, J.; Hickmott, D. D.; Daemen, L. L.
In situ neutron diffraction study of deuterated portlandite Ca(OD)2 at high pressure and temperature Sample: P = 2.35 GPa
Physics and Chemistry of Minerals, 2007, 34, 223-232
9010905 CIFCa D2 O2P -3 m 13.5317; 3.5317; 4.6775
90; 90; 120
50.526Xu, H.; Zhao, Y.; Zhang, J.; Hickmott, D. D.; Daemen, L. L.
In situ neutron diffraction study of deuterated portlandite Ca(OD)2 at high pressure and temperature Sample: P = 2.44 GPa
Physics and Chemistry of Minerals, 2007, 34, 223-232
9010906 CIFCa D2 O2P -3 m 13.5175; 3.5175; 4.6186
90; 90; 120
49.489Xu, H.; Zhao, Y.; Zhang, J.; Hickmott, D. D.; Daemen, L. L.
In situ neutron diffraction study of deuterated portlandite Ca(OD)2 at high pressure and temperature Sample: P = 3.40 GPa
Physics and Chemistry of Minerals, 2007, 34, 223-232
9010907 CIFCa D2 O2P -3 m 13.5002; 3.5002; 4.5646
90; 90; 120
48.431Xu, H.; Zhao, Y.; Zhang, J.; Hickmott, D. D.; Daemen, L. L.
In situ neutron diffraction study of deuterated portlandite Ca(OD)2 at high pressure and temperature Sample: P = 4.53 GPa
Physics and Chemistry of Minerals, 2007, 34, 223-232
9010908 CIFAl0.05 Mg0.99 O2.985 Si0.96P b n m4.7785; 4.9326; 6.9059
90; 90; 90
162.775Kojitani, H.; Katsura, T.; Akaogi, M.
Aluminum substitution mechanisms in perovskite-type MgSiO3: an investigation by Rietveld analysis Sample: Nonstoichiometric with XAl = 0.05
Physics and Chemistry of Minerals, 2007, 34, 257-267
9010909 CIFAl0.1 Mg0.97 O2.979 Si0.93P b n m4.7769; 4.9336; 6.9085
90; 90; 90
162.815Kojitani, H.; Katsura, T.; Akaogi, M.
Aluminum substitution mechanisms in perovskite-type MgSiO3: an investigation by Rietveld analysis Sample: Nonstoichiometric with XAl = 0.10
Physics and Chemistry of Minerals, 2007, 34, 257-267
9010910 CIFAl0.05 Mg0.975 O3 Si0.975P b n m4.7783; 4.9327; 6.9051
90; 90; 90
162.753Kojitani, H.; Katsura, T.; Akaogi, M.
Aluminum substitution mechanisms in perovskite-type MgSiO3: an investigation by Rietveld analysis Sample: Stoichiometric with XAl = 0.05
Physics and Chemistry of Minerals, 2007, 34, 257-267
9010911 CIFAl0.1 Mg0.95 O3 Si0.95P b n m4.7767; 4.9342; 6.913
90; 90; 90
162.934Kojitani, H.; Katsura, T.; Akaogi, M.
Aluminum substitution mechanisms in perovskite-type MgSiO3: an investigation by Rietveld analysis Sample: Stoichiometric with XAl = 0.10
Physics and Chemistry of Minerals, 2007, 34, 257-267
9010912 CIFFe O3 TiR -3 :H5.0881; 5.0881; 14.091
90; 90; 120
315.925Yamanaka, T.; Komatsu, Y.; Nomori, H.
Electron density distribution of FeTiO3 ilmenite under high pressure analyzed by MEM using single crystal diffraction intensities Locality: synthetic Sample: P = 1 atm
Physics and Chemistry of Minerals, 2007, 34, 307-318
9010913 CIFFe O3 TiR -3 :H5.0678; 5.0678; 13.9956
90; 90; 120
311.287Yamanaka, T.; Komatsu, Y.; Nomori, H.
Electron density distribution of FeTiO3 ilmenite under high pressure analyzed by MEM using single crystal diffraction intensities Locality: synthetic Sample: P = 3.6 Gpa
Physics and Chemistry of Minerals, 2007, 34, 307-318
9010914 CIFFe O3 TiR -3 :H5.0567; 5.0567; 13.8892
90; 90; 120
307.569Yamanaka, T.; Komatsu, Y.; Nomori, H.
Electron density distribution of FeTiO3 ilmenite under high pressure analyzed by MEM using single crystal diffraction intensities Locality: synthetic Sample: P = 5.3 GPa
Physics and Chemistry of Minerals, 2007, 34, 307-318
9010915 CIFFe O3 TiR -3 :H5.0398; 5.0398; 13.7968
90; 90; 120
303.484Yamanaka, T.; Komatsu, Y.; Nomori, H.
Electron density distribution of FeTiO3 ilmenite under high pressure analyzed by MEM using single crystal diffraction intensities Locality: synthetic Sample: P = 8.2 GPa
Physics and Chemistry of Minerals, 2007, 34, 307-318
9010916 CIFBi2 Pb S4P n a m11.8021; 14.569; 4.0758
90; 90; 90
700.813Olsen, L. A.; Balic-Zunic T; Makovicky, E.; Ullrich, A.; Miletich, R.
Hydrostatic compression of galenobismutite (PbBi2S4): elastic properties and high-pressure crystal chemistry Sample: P = .0001 GPa
Physics and Chemistry of Minerals, 2007, 34, 467-475
9010917 CIFBi2 Pb S4P n a m11.7854; 14.5531; 4.069
90; 90; 90
697.891Olsen, L. A.; Balic-Zunic T; Makovicky, E.; Ullrich, A.; Miletich, R.
Hydrostatic compression of galenobismutite (PbBi2S4): elastic properties and high-pressure crystal chemistry Sample: P = .16 GPa
Physics and Chemistry of Minerals, 2007, 34, 467-475
9010918 CIFBi2 Pb S4P n a m11.7253; 14.485; 4.0606
90; 90; 90
689.656Olsen, L. A.; Balic-Zunic T; Makovicky, E.; Ullrich, A.; Miletich, R.
Hydrostatic compression of galenobismutite (PbBi2S4): elastic properties and high-pressure crystal chemistry Sample: P = .60 GPa
Physics and Chemistry of Minerals, 2007, 34, 467-475
9010919 CIFBi2 Pb S4P n a m11.6682; 14.435; 4.0424
90; 90; 90
680.863Olsen, L. A.; Balic-Zunic T; Makovicky, E.; Ullrich, A.; Miletich, R.
Hydrostatic compression of galenobismutite (PbBi2S4): elastic properties and high-pressure crystal chemistry Sample: P = 1.39 GPa
Physics and Chemistry of Minerals, 2007, 34, 467-475
9010920 CIFBi2 Pb S4P n a m11.5609; 14.2968; 4.01
90; 90; 90
662.788Olsen, L. A.; Balic-Zunic T; Makovicky, E.; Ullrich, A.; Miletich, R.
Hydrostatic compression of galenobismutite (PbBi2S4): elastic properties and high-pressure crystal chemistry Sample: P = 2.97 GPa
Physics and Chemistry of Minerals, 2007, 34, 467-475
9010921 CIFBi2 Pb S4P n a m11.4902; 14.2045; 3.9895
90; 90; 90
651.136Olsen, L. A.; Balic-Zunic T; Makovicky, E.; Ullrich, A.; Miletich, R.
Hydrostatic compression of galenobismutite (PbBi2S4): elastic properties and high-pressure crystal chemistry Sample: P = 4.15 GPa
Physics and Chemistry of Minerals, 2007, 34, 467-475
9010922 CIFBi2 Pb S4P n a m11.4828; 14.1434; 3.9787
90; 90; 90
646.164Olsen, L. A.; Balic-Zunic T; Makovicky, E.; Ullrich, A.; Miletich, R.
Hydrostatic compression of galenobismutite (PbBi2S4): elastic properties and high-pressure crystal chemistry Sample: P = 4.78 GPa
Physics and Chemistry of Minerals, 2007, 34, 467-475
9010923 CIFBi2 Pb S4P n a m11.3949; 14.0654; 3.9591
90; 90; 90
634.54Olsen, L. A.; Balic-Zunic T; Makovicky, E.; Ullrich, A.; Miletich, R.
Hydrostatic compression of galenobismutite (PbBi2S4): elastic properties and high-pressure crystal chemistry Sample: P = 6.06 GPa
Physics and Chemistry of Minerals, 2007, 34, 467-475
9010924 CIFBi2 Pb S4P n a m11.2963; 13.9073; 3.9266
90; 90; 90
616.873Olsen, L. A.; Balic-Zunic T; Makovicky, E.; Ullrich, A.; Miletich, R.
Hydrostatic compression of galenobismutite (PbBi2S4): elastic properties and high-pressure crystal chemistry Sample: P = 8.65 GPa
Physics and Chemistry of Minerals, 2007, 34, 467-475
9010925 CIFBi2 Pb S4P n a m11.2863; 13.8907; 3.9233
90; 90; 90
615.074Olsen, L. A.; Balic-Zunic T; Makovicky, E.; Ullrich, A.; Miletich, R.
Hydrostatic compression of galenobismutite (PbBi2S4): elastic properties and high-pressure crystal chemistry Sample: P = 8.92 GPa
Physics and Chemistry of Minerals, 2007, 34, 467-475
9010926 CIFAl1.98 Be Cr0.02 O4P n m a9.4082; 5.479; 4.4288
90; 90; 90
228.294Weber, S. U.; Grodzicki, M.; Lottermoser, W.; Redhammer, G. J.; Tippelt, G.; Ponahlo, J.; Amthauer, G.
57Fe Mossbauer spectroscopy, X-ray single-crystal diffractometry, and electronic structure calculations on natural alexandrite Note: changed O1(z) from .788822 to .78822
Physics and Chemistry of Minerals, 2007, 34, 507-515
9010927 CIFGa Li O6 Si2C 1 2/c 19.563; 8.571; 5.269
90; 110.273; 90
405.117Bianchi, R.; Forni, A.; Camara, F.; Oberti, R.; Ohashi, H.
Experimental multipole-refined and theoretical charge density study of LiGaSi2O6 clinopyroxene at ambient conditions
Physics and Chemistry of Minerals, 2007, 34, 519-527
9010928 CIFC Ba O3P m c n5.3103; 8.9122; 6.4365
90; 90; 90
304.617Antao, S. M.; Hassan, I.
BaCO3: high-temperature crystal structures and the Pmcn –> R3m phase transition at 811 C Sample: T = 25 C
Physics and Chemistry of Minerals, 2007, 34, 573-580
9010929 CIFC Ba O3P m c n5.314; 8.9146; 6.4642
90; 90; 90
306.223Antao, S. M.; Hassan, I.
BaCO3: high-temperature crystal structures and the Pmcn –> R3m phase transition at 811 C Sample: T = 93 C
Physics and Chemistry of Minerals, 2007, 34, 573-580
9010930 CIFC Ba O3P m c n5.319; 8.9189; 6.5019
90; 90; 90
308.448Antao, S. M.; Hassan, I.
BaCO3: high-temperature crystal structures and the Pmcn –> R3m phase transition at 811 C Sample: T = 196 C
Physics and Chemistry of Minerals, 2007, 34, 573-580
9010931 CIFC Ba O3P m c n5.3226; 8.9212; 6.5374
90; 90; 90
310.422Antao, S. M.; Hassan, I.
BaCO3: high-temperature crystal structures and the Pmcn –> R3m phase transition at 811 C Sample: T = 298 C
Physics and Chemistry of Minerals, 2007, 34, 573-580
9010932 CIFC Ba O3P m c n5.3264; 8.9247; 6.5751
90; 90; 90
312.557Antao, S. M.; Hassan, I.
BaCO3: high-temperature crystal structures and the Pmcn –> R3m phase transition at 811 C Sample: T = 401 C
Physics and Chemistry of Minerals, 2007, 34, 573-580
9010933 CIFC Ba O3P m c n5.3293; 8.9275; 6.6076
90; 90; 90
314.372Antao, S. M.; Hassan, I.
BaCO3: high-temperature crystal structures and the Pmcn –> R3m phase transition at 811 C Sample: T = 486 C
Physics and Chemistry of Minerals, 2007, 34, 573-580
9010934 CIFC Ba O3P m c n5.3322; 8.931; 6.6537
90; 90; 90
316.862Antao, S. M.; Hassan, I.
BaCO3: high-temperature crystal structures and the Pmcn –> R3m phase transition at 811 C Sample: T = 606 C
Physics and Chemistry of Minerals, 2007, 34, 573-580
9010935 CIFC Ba O3P m c n5.3336; 8.9354; 6.6877
90; 90; 90
318.721Antao, S. M.; Hassan, I.
BaCO3: high-temperature crystal structures and the Pmcn –> R3m phase transition at 811 C Sample: T = 691 C
Physics and Chemistry of Minerals, 2007, 34, 573-580
9010936 CIFC Ba O3P m c n5.3337; 8.9361; 6.6949
90; 90; 90
319.096Antao, S. M.; Hassan, I.
BaCO3: high-temperature crystal structures and the Pmcn –> R3m phase transition at 811 C Sample: T = 708 C
Physics and Chemistry of Minerals, 2007, 34, 573-580
9010937 CIFC Ba O3P m c n5.3338; 8.9403; 6.7252
90; 90; 90
320.696Antao, S. M.; Hassan, I.
BaCO3: high-temperature crystal structures and the Pmcn –> R3m phase transition at 811 C Sample: T = 777 C
Physics and Chemistry of Minerals, 2007, 34, 573-580
9010938 CIFC Ba O3P m c n5.3333; 8.9417; 6.7339
90; 90; 90
321.131Antao, S. M.; Hassan, I.
BaCO3: high-temperature crystal structures and the Pmcn –> R3m phase transition at 811 C Sample: T = 794 C
Physics and Chemistry of Minerals, 2007, 34, 573-580
9010939 CIFFe3 O4F d -3 m :28.395; 8.395; 8.395
90; 90; 90
591.646Gatta, G. D.; Kantor, I.; Ballaran, T. B.; Dubrovinsky, L.; McCammon, C.
Effect of non-hydrostatic conditions on the elastic behaviour of magnetite: an in situ single-crystal X-ray diffraction study Sample: P = 0.0001 GPa, T = 293 K
Physics and Chemistry of Minerals, 2007, 34, 627-635
9010940 CIFFe3 O4F d -3 m :28.3198; 8.3198; 8.3198
90; 90; 90
575.889Gatta, G. D.; Kantor, I.; Ballaran, T. B.; Dubrovinsky, L.; McCammon, C.
Effect of non-hydrostatic conditions on the elastic behaviour of magnetite: an in situ single-crystal X-ray diffraction study Sample: P = 4.99 GPa, T = 293 K
Physics and Chemistry of Minerals, 2007, 34, 627-635
9010941 CIFFe3 O4F d -3 m :28.2634; 8.2634; 8.2634
90; 90; 90
564.256Gatta, G. D.; Kantor, I.; Ballaran, T. B.; Dubrovinsky, L.; McCammon, C.
Effect of non-hydrostatic conditions on the elastic behaviour of magnetite: an in situ single-crystal X-ray diffraction study Sample: P = 9.21 GPa, T = 293 K
Physics and Chemistry of Minerals, 2007, 34, 627-635
9010942 CIFAl D0.744 H0.256 O2P 21 n m4.71236; 4.2311; 2.8289
90; 90; 90
56.404Vanpeteghem, C. B.; Sano, A.; Komatsu, K.; Ohtani, E.; Suzuki, A.
Neutron diffraction study of aluminous hydroxide d-AlOOD
Physics and Chemistry of Minerals, 2007, 34, 657-661
9010943 CIFF3 Mg NaP b n m5.3622; 5.4885; 7.6694
90; 90; 90
225.714Mitchell, R. H.; Alexander, M.; Cranswick, L. M. D.; Swainson, I. P.
A powder neutron diffraction study of the crystal structure of the fluoroperovskite NaMgF3 (neighborite) from 300 to 3.6 K Sample: T = 300 K
Physics and Chemistry of Minerals, 2007, 34, 705-712
9010944 CIFF3 Mg NaP b n m5.358; 5.4874; 7.6642
90; 90; 90
225.339Mitchell, R. H.; Alexander, M.; Cranswick, L. M. D.; Swainson, I. P.
A powder neutron diffraction study of the crystal structure of the fluoroperovskite NaMgF3 (neighborite) from 300 to 3.6 K Sample: T = 275 K
Physics and Chemistry of Minerals, 2007, 34, 705-712
9010945 CIFF3 Mg NaP b n m5.3535; 5.4858; 7.6596
90; 90; 90
224.949Mitchell, R. H.; Alexander, M.; Cranswick, L. M. D.; Swainson, I. P.
A powder neutron diffraction study of the crystal structure of the fluoroperovskite NaMgF3 (neighborite) from 300 to 3.6 K Sample: T = 250 K
Physics and Chemistry of Minerals, 2007, 34, 705-712
9010946 CIFF3 Mg NaP b n m5.3494; 5.4846; 7.6557
90; 90; 90
224.613Mitchell, R. H.; Alexander, M.; Cranswick, L. M. D.; Swainson, I. P.
A powder neutron diffraction study of the crystal structure of the fluoroperovskite NaMgF3 (neighborite) from 300 to 3.6 K Sample: T = 225 K
Physics and Chemistry of Minerals, 2007, 34, 705-712
9010947 CIFF3 Mg NaP b n m5.3453; 5.4835; 7.6507
90; 90; 90
224.249Mitchell, R. H.; Alexander, M.; Cranswick, L. M. D.; Swainson, I. P.
A powder neutron diffraction study of the crystal structure of the fluoroperovskite NaMgF3 (neighborite) from 300 to 3.6 K Sample: T = 200 K
Physics and Chemistry of Minerals, 2007, 34, 705-712

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