Crystallography Open Database

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9004694 CIFCl2 Cu2 OF d d d :27.4691; 9.5969; 9.7
90; 90; 90
695.298Krivovichev, S. V.; Filatov, S. K.; Burns, P. C.
The cuprite-like framework of OCu4 tetrahedra in the crystal structure of synthetic melanothallite, Cu2OCl2, and its negative thermal expansion
The Canadian Mineralogist, 2002, 40, 1185-1190
9004695 CIFAs2 Ca Fe2 H2 O10C c c m16.461; 7.434; 12.131
90; 90; 90
1484.48Roberts, A. C.; Cooper, M. A.; Hawthorne, F. C.; Criddle, A. J.; Stirling, J. A. R.
Sewardite, CaFe2(AsO4)(OH)2, the Ca-analogue of carminite, from Tsumeb, Namibia: Description and crystal structure
The Canadian Mineralogist, 2002, 40, 1191-1198
9004696 CIFB5 Ca2 H7 O13P 1 21/c 111.623; 6.976; 12.35
90; 110.7; 90
936.719Wallwork, K. S.; Pring, A.; Taylor, M. R.; Hunter, B. A.
The structure of priceite, a basic hydrated calcium borate, by ab initio powder-diffraction methods
The Canadian Mineralogist, 2002, 40, 1199-1206
9004697 CIFO6 Sb2 ZnP 42/m n m4.6638; 4.6638; 9.263
90; 90; 90
201.48Ercit, T. S.; Foord, E. E.; Fitzpatrick, J. J.
Ordonezite from the Theodoso Soto Mine, Sapioris, Durango, Mexico: New data and structure refinement
The Canadian Mineralogist, 2002, 40, 1207-1210
9004698 CIFCa5.49 F3 Fe0.03 Mn0.03 Na2.37 Nb1.61 O22 Si4 Sr0.08 Ti2.39C 1 2/c 110.183; 10.183; 20.396
90; 97.19; 90
2098.3Sokolova, E. V.; Hawthorne, F. C.; Khomyakov, A. P.
The crystal chemistry of fersmanite, Ca4(Na,Ca)4(Ti,Nb)4(Si2O7)2O8F3
The Canadian Mineralogist, 2002, 40, 1421-1428
9004699 CIFH16 K Mg O22 V5P -18.8178; 10.7236; 11.0707
65.789; 74.057; 71.853
894.126Hughes, J. M.; Schindler, M.; Rakovan, J. F.; Cureton, F. E.
The crystal structure of hummerite, K Mg(V5O14).8H2O: Bonding between the [V10O28] structural units and the {K2Mg2(H2O)16} interstitial complex
The Canadian Mineralogist, 2002, 40, 1429-1435
9004700 CIFAg6 As7 Cu14.08P m -3 m11.78079; 11.78079; 11.78079
90; 90; 90
1635.02Karanovic, L.; Poleti, D.; Makovicky, E.; Balic-Zunic T; Makovicky, M.
The crystal structure of synthetic kutinaite, Cu14Ag6As7
The Canadian Mineralogist, 2002, 40, 1437-1449
9004701 CIFH4 Mo2 O11 UC 1 2/c 135.071; 6.717; 11.513
90; 90.069; 90
2712.14Krivovichev, S. V.; Burns, P. C.
Crystal chemistry of uranyl molybdates. VII. An iriginite-type sheet of polyhedra in the structure of [(UO2)Mo2O7(H2O)2]
The Canadian Mineralogist, 2002, 40, 1571-1577
9004702 CIFH9 Na O17 U4P -18.0746; 8.4633; 11.2191
80.398; 87.492; 71.308
716.036Burns, P. C.; Deely, K. M.
A topologically novel sheet of uranyl pentagonal bipyramids in the structure of Na[(UO2)4O2(OH)5](H2O)2
The Canadian Mineralogist, 2002, 40, 1579-1586
9004703 CIFCd Cl9 Cu7 K O8 Se2P 63/m m c8.7805; 8.7805; 15.521
90; 90; 120
1036.31Burns, P. C.; Krivovichev, S. V.; Filatov, S. K.
New Cu coordination polyhedra in the crystal structure of burnsite, KCdCu7O2(SeO3)2Cl9
The Canadian Mineralogist, 2002, 40, 1587-1595
9004704 CIFAs2 Ca H5.18 Mg0.34 Mn1.18 O10C 1 2/m 19.043; 6.2314; 7.3889
90; 116.392; 90
372.972Brugger, J.; Krivovichev, S. V.; Kolitsch, U.; Meisser, N.; Andrut, M.; Ansermet, S.; Burns, P. C.
Description and crystal structure of manganlotharmeyerite, Ca(Mn,_,Mg)2{AsO4,[AsO2(OH)2]}2(OH,H2O)2, from the Starlera Mn-deposit, Swiss Alps, and a redefinition of lotharmeyerite
The Canadian Mineralogist, 2002, 40, 1597-1608
9004705 CIFCa0.02 Fe0.56 H20 K2.52 Mn0.38 Na0.72 Nb2.16 O34.74 Si8 Ti1.72 Zr0.04C 1 2/m 114.529; 13.943; 7.837
90; 117.61; 90
1406.81Raade, G.; Ferraris, G.; Gula, A.; Ivaldi, G.
Gjerdingenite-Fe from Norway, a new mineral species in the labuntsovite group: Description, crystal structure and twinning
The Canadian Mineralogist, 2002, 40, 1629-1639
9004706 CIFO4 P0.952 Sc0.904 Si0.048 Y0.032 Yb0.016 Zr0.048I 41/a m d :26.587; 6.587; 5.809
90; 90; 90
252.044Moelo, Y.; Lulzac, Y.; Rouer, O.; Palvadeau, P.; Gloaguen, E.; Leone, P.
Scandium mineralogy: pretulite with scandian zircon and xenotime-(Y) with an apatite-rich oolitic ironstone from Saint-Aubin-des-Chateaux, Armorican Massif, France
The Canadian Mineralogist, 2002, 40, 1657-1673
9004707 CIFB26 Ca8 Cl3 H52 Mg O72P b a 215.5484; 22.672; 8.7722
90; 90; 90
3092.32Grice, J. D.; Gault, R. A.; Van Velthuizen, J.; Pratt, A.
Walkerite, a new borate mineral species in an evaporitic sequence from Sussex, New Brunswick, Canada
The Canadian Mineralogist, 2002, 40, 1675-1686
9004708 CIFCa0.038 Cr0.029 Fe0.558 Mg0.321 Mn0.048 S Ti0.001 Zn0.003F m -3 m5.2; 5.2; 5.2
90; 90; 90
140.608Shimizu, M.; Yoshida, H.; Mandarino, J. A.
The new mineral species keilite, (Fe,Mg)S, the iron-dominant analogue of niningerite
The Canadian Mineralogist, 2002, 40, 1687-1692
9005533 CIFCa0.55 Fe5.06 H2 K Na1.39 O24 Si8C 1 2/m 110.1448; 18.1841; 5.2962
90; 104.415; 90
946.253Redhammer, G. J.; Roth, G.
Crystal structure and Mossbauer spectroscopy of the synthetic amphibole potassic-ferri-ferrorichterite at 298 K and low temperatures (80-110 K) Sample: Ri1, T = 298 K
European Journal of Mineralogy, 2002, 14, 105-114
9005534 CIFCa0.57 Fe5.06 H2 K Na1.37 O24 Si8C 1 2/m 110.1306; 18.1678; 5.2889
90; 104.54; 90
942.25Redhammer, G. J.; Roth, G.
Crystal structure and Mossbauer spectroscopy of the synthetic amphibole potassic-ferri-ferrorichterite at 298 K and low temperatures (80-110 K) Sample: Ri1, T = 110 K
European Journal of Mineralogy, 2002, 14, 105-114
9005535 CIFCa0.52 Fe5 H2 K Na1.48 O24 Si8C 1 2/m 110.1361; 18.1648; 5.303
90; 104.327; 90
946.023Redhammer, G. J.; Roth, G.
Crystal structure and Mossbauer spectroscopy of the synthetic amphibole potassic-ferri-ferrorichterite at 298 K and low temperatures (80-110 K) Sample: Ri15, T = 298 K
European Journal of Mineralogy, 2002, 14, 105-114
9005536 CIFAs2 Bi0.653 Ca0.347 Co1.04 Fe0.36 H5 Ni0.6 O10C 1 2/m 19.005; 6.211; 7.44
90; 115.19; 90
376.547Krause, W.; Bernhardt, H. J.; Effenberger, H.; Witzke, T.
Schneebergite and nickelschneebergite from Schneeberg, Saxony, Germany: the first Bi-bearing members of the tsumcorite group Sample: #358
European Journal of Mineralogy, 2002, 14, 115-126
9005537 CIFAs2 Bi0.551 Ca0.449 Co0.62 Fe0.4 H5 Ni O10C 1 2/m 18.995; 6.207; 7.462
90; 115; 90
377.584Krause, W.; Bernhardt, H. J.; Effenberger, H.; Witzke, T.
Schneebergite and nickelschneebergite from Schneeberg, Saxony, Germany: the first Bi-bearing members of the tsumcorite group Sample: #374
European Journal of Mineralogy, 2002, 14, 115-126
9005538 CIFFe1.544 H Mg0.456 O5 PP 3 1 m11.355; 11.355; 5.0394
90; 90; 120
562.709Kolitsch, U.; Andrut, M.; Giester, G.
Satterlyite, (Fe,Mg)12(PO3OH)(PO4)5(OH,O)6: crystal structure and infrared absorption spectra Note: z-coordinate of O6 altered by author, August 2003.
European Journal of Mineralogy, 2002, 14, 127-133
9005539 CIFCl2 H4 O8 Pb7C 1 1 215.791; 12.998; 19.33
90; 90; 90.089
1454.99Krivovichev, S. V.; Burns, P. C.
Crystal chemistry of lead oxide chlorides. II. Crystal structure of Pb7O4(OH)4Cl2
European Journal of Mineralogy, 2002, 14, 135-139
9005540 CIFBa H16 Mg5 O24 P4P 1 21/c 18.3354; 12.8304; 18.313
90; 90.025; 90
1958.51Krivovichev, S. V.; Britvin, S. N.; Burns, P. C.; Yakovenchuk, V. N.
Crystal structure of rimkorolgite, Ba[Mg5(H2O)7(PO4)4](H2O), and its comparison with bakhchisaraitsevite
European Journal of Mineralogy, 2002, 14, 397-402
9005541 CIFCa0.15 Mg1.85 O6 Si2P 1 21/c 19.654; 8.845; 5.203
90; 108.37; 90
421.642Tribaudino, M.; Nestola, F.
Average and local structure in P2_1/c clinopyroxenes along the join diopside-enstatite (CaMgSi2O6-Mg2Si2O6) Sample: Di15En85 (non-split model) Note: x-coordinate for SiTA altered by Tribaudino, Sept 2003
European Journal of Mineralogy, 2002, 14, 549-555
9005542 CIFCa0.15 Mg1.85 O6 Si2P 1 21/c 19.654; 8.845; 5.203
90; 108.37; 90
421.642Tribaudino, M.; Nestola, F.
Average and local structure in P2_1/c clinopyroxenes along the join diopside-enstatite (CaMgSi2O6-Mg2Si2O6) Sample: Di15En85 (split model)
European Journal of Mineralogy, 2002, 14, 549-555
9005543 CIFCa0.23 Mg1.77 O6 Si2P 1 21/c 19.69; 8.862; 5.229
90; 108.31; 90
426.295Tribaudino, M.; Nestola, F.
Average and local structure in P2_1/c clinopyroxenes along the join diopside-enstatite (CaMgSi2O6-Mg2Si2O6) Sample: Di23En77 (non-split model)
European Journal of Mineralogy, 2002, 14, 549-555
9005544 CIFCa0.23 Mg1.77 O6 Si2P 1 21/c 19.69; 8.862; 5.229
90; 108.31; 90
426.295Tribaudino, M.; Nestola, F.
Average and local structure in P2_1/c clinopyroxenes along the join diopside-enstatite (CaMgSi2O6-Mg2Si2O6) Sample: Di23En77 (split model)
European Journal of Mineralogy, 2002, 14, 549-555
9005545 CIFAl2 Ca H6 O13 Si3C 1 c 16.533; 19.03; 9.83
90; 109.95; 90
1148.76Comodi, P.; Gatta, G. D.; Zanazzi, P. F.
High-pressure structural behaviour of scolecite Sample: P = .0001 GPa
European Journal of Mineralogy, 2002, 14, 567-574
9005546 CIFAl2 Ca H6 O13 Si3C 1 c 16.471; 18.804; 9.723
90; 109.79; 90
1113.23Comodi, P.; Gatta, G. D.; Zanazzi, P. F.
High-pressure structural behaviour of scolecite Sample: P = 1.77 GPa
European Journal of Mineralogy, 2002, 14, 567-574
9005547 CIFAl2 Ca H6 O13 Si3C 1 c 16.43; 18.631; 9.363
90; 109.6; 90
1056.67Comodi, P.; Gatta, G. D.; Zanazzi, P. F.
High-pressure structural behaviour of scolecite Sample: P = 3.38 GPa
European Journal of Mineralogy, 2002, 14, 567-574
9005548 CIFAl2 Ca H6 O13 Si3C 1 c 16.542; 18.842; 9.863
90; 109.89; 90
1143.23Comodi, P.; Gatta, G. D.; Zanazzi, P. F.
High-pressure structural behaviour of scolecite Sample: P = .0001 GPa (after compression) Note: y-coordinate of O5 altered to match bond lengths
European Journal of Mineralogy, 2002, 14, 567-574
9005549 CIFCu1.798 SF m -3 m5.589; 5.589; 5.589
90; 90; 90
174.583Will, G.; Hinze, E.; Abdelrahman, A. R. M.
Crystal structure analysis and refinement of digenite, Cu1.8S, in the temperature range 20 to 500 C under controlled sulfur partial pressure Sample: T = 200 C
European Journal of Mineralogy, 2002, 14, 591-598
9005550 CIFCu2.001 SP 63/m m c4.033; 4.033; 6.739
90; 90; 120
94.925Will, G.; Hinze, E.; Abdelrahman, A. R. M.
Crystal structure analysis and refinement of digenite, Cu1.8S, in the temperature range 20 to 500 C under controlled sulfur partial pressure Sample: T = 300 C, sometimes called high-chalcocite
European Journal of Mineralogy, 2002, 14, 591-598
9005551 CIFCu1.798 SF m -3 m5.593; 5.593; 5.593
90; 90; 90
174.958Will, G.; Hinze, E.; Abdelrahman, A. R. M.
Crystal structure analysis and refinement of digenite, Cu1.8S, in the temperature range 20 to 500 C under controlled sulfur partial pressure Sample: T = 400 C
European Journal of Mineralogy, 2002, 14, 591-598
9005552 CIFCu1.997 SF m -3 m5.639; 5.639; 5.639
90; 90; 90
179.311Will, G.; Hinze, E.; Abdelrahman, A. R. M.
Crystal structure analysis and refinement of digenite, Cu1.8S, in the temperature range 20 to 500 C under controlled sulfur partial pressure Sample: T = 500 C, sometimes called high-digenite
European Journal of Mineralogy, 2002, 14, 591-598
9005553 CIFPb6 S17 Sb6P 21 2 2115.328; 4.04; 23.054
90; 90; 90
1427.62Orlandi, P.; Meerschaut, A.; Palvadeau, P.; Merlino, S.
Lead-antimony sulfosalts from Tuscany (Italy). V. Definition and crystal structure of moeloite, Pb6Sb6S14(S3), a new mineral from the Ceragiola marble quarry
European Journal of Mineralogy, 2002, 14, 599-606
9005554 CIFAl8.88 B5.22 Na0.77 O31 Si3.78R 3 m :H15.5996; 15.5996; 7.0224
90; 90; 120
1479.94Marler, B.; Borowski, M.; Wodara, U.; Schreyer, W.
Synthetic tourmaline (olenite) with excess boron replacing silicon in the tetrahedral site: II. Structure analysis Sample: 1
European Journal of Mineralogy, 2002, 14, 763-771
9005555 CIFAl8.88 B4.8 Na0.67 O31 Si4.2R 3 m :H15.6329; 15.6329; 7.0365
90; 90; 120
1489.25Marler, B.; Borowski, M.; Wodara, U.; Schreyer, W.
Synthetic tourmaline (olenite) with excess boron replacing silicon in the tetrahedral site: II. Structure analysis Sample: 2
European Journal of Mineralogy, 2002, 14, 763-771
9005556 CIFAl0.608 Ca2.898 Fe1.321 Mg0.072 Mn0.018 O12 Si2.862 Ti0.213 Zr0.006I a -3 d12.01; 12.01; 12.01
90; 90; 90
1732.32Agrosi, G.; Schingaro, E.; Pedrazzi, G.; Scandale, E.; Scordari, F.
A crystal chemical insight into sector zoning of a titanian andradite ('melanite') crystal Sample: (121)
European Journal of Mineralogy, 2002, 14, 785-794
9005557 CIFAl0.632 Ca2.892 Fe1.311 Mg0.072 Mn0.018 O12 Si2.874 Ti0.192 Zr0.009I a -3 d12.014; 12.014; 12.014
90; 90; 90
1734.06Agrosi, G.; Schingaro, E.; Pedrazzi, G.; Scandale, E.; Scordari, F.
A crystal chemical insight into sector zoning of a titanian andradite ('melanite') crystal Sample: (011)
European Journal of Mineralogy, 2002, 14, 785-794
9005558 CIFAl0.634 Ca2.895 Fe1.302 Mg0.072 Mn0.018 O12 Si2.877 Ti0.192 Zr0.009I a -3 d12.007; 12.007; 12.007
90; 90; 90
1731.03Agrosi, G.; Schingaro, E.; Pedrazzi, G.; Scandale, E.; Scordari, F.
A crystal chemical insight into sector zoning of a titanian andradite ('melanite') crystal Sample: (110)
European Journal of Mineralogy, 2002, 14, 785-794
9005559 CIFAl0.301 Ca0.752 K0.23 Mg0.749 O6 Si1.968C 1 2/c 19.803; 8.985; 5.263
90; 105.69; 90
446.292Bindi, L.; Safonov, O. G.; Litvin, Y. A.; Perchuk, L. L.; Menchetti, S.
Ultrahigh potassium content in the clinopyroxene structure: an X-ray single-crystal study Sample: K1
European Journal of Mineralogy, 2002, 14, 929-934
9005560 CIFAl0.209 Ca0.896 K0.072 Mg0.887 O6 Si1.936C 1 2/c 19.744; 8.904; 5.273
90; 106.14; 90
439.457Bindi, L.; Safonov, O. G.; Litvin, Y. A.; Perchuk, L. L.; Menchetti, S.
Ultrahigh potassium content in the clinopyroxene structure: an X-ray single-crystal study Sample: K2
European Journal of Mineralogy, 2002, 14, 929-934
9005561 CIFAl8.469 B3.438 H3 Na0.58 O31 Si5.562R 3 m :H15.792; 15.792; 7.0878
90; 90; 120
1530.79Schreyer, W.; Hughes, J. M.; Bernhardt, H. J.; Kalt, A.; Prowatke, S.; Ertl, A.
Reexamination of olenite from the type locality: detection of boron in tetrahedral coordination Note: z-coordinate for AlY and y-coordinate for H were altered by Hughes, Aug 2003
European Journal of Mineralogy, 2002, 14, 935-942
9005562 CIFAl7 Fe2.6 H Mg O16 Ti0.4P 63 m c5.712; 5.712; 18.317
90; 90; 120
517.561Hejny, C.; Gnos, E.; Grobety, B.; Armbruster, T.
Crystal chemistry of the polysome ferrohogbomite-2N2S, a long-known but newly defined mineral species
European Journal of Mineralogy, 2002, 14, 957-967
9005563 CIFCa0.14 Ce3.686 Fe1.74 H1.28 Mg0.24 Nb0.14 O22 Si4 Ti2.74C 1 2/m 113.456; 5.728; 11.083
90; 100.6; 90
839.656Yang, Z.; Fleck, M.; Smith, M.; Tao, K.; Song, R.; Zhang, P.
The crystal structure of natural Fe-rich chevkinite-(Ce)
European Journal of Mineralogy, 2002, 14, 969-975
9005564 CIFO22 Si4 Sr4 Ti5C 1 2/m 113.85; 5.631; 11.892
90; 114.143; 90
846.323Miyajima, H.; Miyawaki, R.; Ito, K.
Matsubaraite, Sr4Ti5(Si2O7)2O8, a new mineral, the Sr-Ti analogue of perrierite in jadeitite from the Itoigawa-Ohmi district, Niigata Prefecture, Japan
European Journal of Mineralogy, 2002, 14, 1119-1128
9007046 CIFFe2 O4 SiP n m a10.4597; 6.0818; 4.815
90; 90; 90
306.3Lottermoser, W.; Steiner, K.; Grodzicki, M.; Jiang, K.; Scharfetter, G.; Bats, J. W.; Redhammer, G. J.; Treutmann, W.; Hosoya, S.; Amthauer, G.
The electric field gradient in synthetic fayalite alpha-Fe2SiO4 at moderate temperatures Sample: T = 153 K
Physics and Chemistry of Minerals, 2002, 29, 112-121
9007047 CIFFe SiP 21 34.5507; 4.5507; 4.5507
90; 90; 90
94.24Vocadlo, L.; Knight, K. S.; Price, G. D.; Wood, I. G.
Thermal expansion and crystal structure of FeSi between 4 and 1173 K determined by time-of-flight neutron powder diffraction Sample: T = 300 K, epsilon FeSi phase
Physics and Chemistry of Minerals, 2002, 29, 132-139
9007048 CIFS3 Sb2P n m a11.292; 3.828; 11.205
90; 90; 90
484.345Kyono, A.; Kimata, M.; Matsuhisa, M.; Miyashita, Y.; Okamoto, K.
Low-temperature crystal structures of stibnite implying orbital overlap of Sb 5s2 inert pair electrons Sample: T = 128 K
Physics and Chemistry of Minerals, 2002, 29, 254-260

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