American Mineralogist Crystal Structure Database

15 matching records for this search.

Pseudobrookite
Download hom/pseudobrookite.pdf
Yang H, Hazen R M
Download am/vol84/AM84_130.pdf
American Mineralogist 84 (1999) 130-137
Comparative high-pressure crystal chemistry of karrooite, MgTi2O5, with
different ordering states
Sample P600, x(Ti) in M1 = .070, P = 0 GPa
_database_code_amcsd 0002073
9.7131 10.0190 3.7363 90 90 90 Bbmm
atom     x     y z  occ Biso
Mg1  .8052   .25 0  .93  .47
Ti1  .8052   .25 0  .07  .47
Ti2  .1335 .4332 0 .965  .38
Mg2  .1335 .4332 0 .035  .38
O1   .2188   .25 0       .54
O2   .0459 .8865 0       .68
O3   .3136 .9374 0       .56
Download AMC data (View Text File)
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Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Pseudobrookite
Download hom/pseudobrookite.pdf
Yang H, Hazen R M
Download am/vol84/AM84_130.pdf
American Mineralogist 84 (1999) 130-137
Comparative high-pressure crystal chemistry of karrooite, MgTi2O5, with
different ordering states
Sample P600, x(Ti) in M1 = .070, P = 1.03 GPa
_database_code_amcsd 0002074
9.6944 9.9924 3.7316 90 90 90 Bbmm
atom     x     y z  occ Biso
Mg1  .8050   .25 0  .93  .51
Ti1  .8050   .25 0  .07  .51
Ti2  .1334 .4332 0 .965  .39
Mg2  .1334 .4332 0 .035  .39
O1   .2195   .25 0       .63
O2   .0459 .8862 0       .71
O3   .3140 .9380 0       .54
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Pseudobrookite
Download hom/pseudobrookite.pdf
Yang H, Hazen R M
Download am/vol84/AM84_130.pdf
American Mineralogist 84 (1999) 130-137
Comparative high-pressure crystal chemistry of karrooite, MgTi2O5, with
different ordering states
Sample P600, x(Ti) in M1 = .070, P = 2.16 GPa
_database_code_amcsd 0002075
9.6739 9.9651 3.7265 90 90 90 Bbmm
atom     x     y z  occ Biso
Mg1  .8046   .25 0  .93  .51
Ti1  .8046   .25 0  .07  .51
Ti2  .1335 .4333 0 .965  .39
Mg2  .1335 .4333 0 .035  .39
O1   .2197   .25 0       .56
O2   .0466 .8861 0       .72
O3   .3142 .9377 0       .55
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Pseudobrookite
Download hom/pseudobrookite.pdf
Yang H, Hazen R M
Download am/vol84/AM84_130.pdf
American Mineralogist 84 (1999) 130-137
Comparative high-pressure crystal chemistry of karrooite, MgTi2O5, with
different ordering states
Sample P600, x(Ti) in M1 = .070, P = 3.22 GPa
_database_code_amcsd 0002076
9.6540 9.9387 3.7218 90 90 90 Bbmm
atom     x     y z  occ Biso
Mg1  .8045   .25 0  .93  .50
Ti1  .8045   .25 0  .07  .50
Ti2  .1335 .4333 0 .965  .37
Mg2  .1335 .4333 0 .035  .37
O1   .2197   .25 0       .56
O2   .0461 .8858 0       .73
O3   .3141 .9377 0       .55
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Pseudobrookite
Download hom/pseudobrookite.pdf
Yang H, Hazen R M
Download am/vol84/AM84_130.pdf
American Mineralogist 84 (1999) 130-137
Comparative high-pressure crystal chemistry of karrooite, MgTi2O5, with
different ordering states
Sample P600, x(Ti) in M1 = .070, P = 4.34 GPa
_database_code_amcsd 0002077
9.6349 9.9143 3.7168 90 90 90 Bbmm
atom     x     y z  occ Biso
Mg1  .8044   .25 0  .93  .44
Ti1  .8044   .25 0  .07  .44
Ti2  .1336 .4334 0 .965  .35
Mg2  .1336 .4334 0 .035  .35
O1   .2202   .25 0       .47
O2   .0465 .8856 0       .58
O3   .3142 .9379 0       .54
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Pseudobrookite
Download hom/pseudobrookite.pdf
Yang H, Hazen R M
Download am/vol84/AM84_130.pdf
American Mineralogist 84 (1999) 130-137
Comparative high-pressure crystal chemistry of karrooite, MgTi2O5, with
different ordering states
Sample P600, x(Ti) in M1 = .070, P = 6.20 GPa
_database_code_amcsd 0002078
9.5992 9.8667 3.7085 90 90 90 Bbmm
atom     x     y z  occ Biso
Mg1  .8039   .25 0  .93  .39
Ti1  .8039   .25 0  .07  .39
Ti2  .1336 .4333 0 .965  .36
Mg2  .1336 .4333 0 .035  .36
O1   .2210   .25 0       .71
O2   .0464 .8848 0       .60
O3   .3147 .9382 0       .50
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Pseudobrookite
Download hom/pseudobrookite.pdf
Yang H, Hazen R M
Download am/vol84/AM84_130.pdf
American Mineralogist 84 (1999) 130-137
Comparative high-pressure crystal chemistry of karrooite, MgTi2O5, with
different ordering states
Sample P600, x(Ti) in M1 = .070, P = 7.51 GPa
_database_code_amcsd 0002079
9.5754 9.8352 3.7029 90 90 90 Bbmm
atom     x     y z  occ Biso
Mg1  .8040   .25 0  .93  .45
Ti1  .8040   .25 0  .07  .45
Ti2  .1337 .4334 0 .965  .42
Mg2  .1337 .4334 0 .035  .42
O1   .2215   .25 0       .65
O2   .0467 .8846 0       .69
O3   .3146 .9379 0       .50
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Pseudobrookite
Download hom/pseudobrookite.pdf
Yang H, Hazen R M
Download am/vol84/AM84_130.pdf
American Mineralogist 84 (1999) 130-137
Comparative high-pressure crystal chemistry of karrooite, MgTi2O5, with
different ordering states
Sample P1400, x(Ti) in M1 = .485, P = 0.00 GPa
_database_code_amcsd 0002080
9.7602 9.9796 3.7479 90 90 90 Bbmm
atom     x     y z   occ Biso
Mg1  .8085   .25 0  .515  .50
Ti1  .8085   .25 0  .485  .50
Ti2  .1357 .4369 0 .7575  .55
Mg2  .1357 .4369 0 .2425  .55
O1   .2341   .25 0       1.16
O2   .0467 .8841 0        .83
O3   .3110 .9304 0        .67
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Pseudobrookite
Download hom/pseudobrookite.pdf
Yang H, Hazen R M
Download am/vol84/AM84_130.pdf
American Mineralogist 84 (1999) 130-137
Comparative high-pressure crystal chemistry of karrooite, MgTi2O5, with
different ordering states
Sample P1400, x(Ti) in M1 = .485, P = 1.03 GPa
_database_code_amcsd 0002081
9.7392 9.9539 3.7426 90 90 90 Bbmm
atom     x     y z   occ Biso
Mg1  .8081   .25 0  .515  .55
Ti1  .8081   .25 0  .485  .55
Ti2  .1357 .4368 0 .7575  .54
Mg2  .1357 .4368 0 .2425  .54
O1   .2338   .25 0       1.03
O2   .0471 .8832 0        .87
O3   .3109 .9303 0        .86
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Pseudobrookite
Download hom/pseudobrookite.pdf
Yang H, Hazen R M
Download am/vol84/AM84_130.pdf
American Mineralogist 84 (1999) 130-137
Comparative high-pressure crystal chemistry of karrooite, MgTi2O5, with
different ordering states
Sample P1400, x(Ti) in M1 = .485, P = 2.16 GPa
_database_code_amcsd 0002082
9.7166 9.9275 3.7369 90 90 90 Bbmm
atom     x     y z   occ Biso
Mg1  .8081   .25 0  .515  .55
Ti1  .8081   .25 0  .485  .55
Ti2  .1357 .4367 0 .7575  .55
Mg2  .1357 .4367 0 .2425  .55
O1   .2339   .25 0       1.03
O2   .0472 .8832 0        .82
O3   .3112 .9301 0        .81
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Pseudobrookite
Download hom/pseudobrookite.pdf
Yang H, Hazen R M
Download am/vol84/AM84_130.pdf
American Mineralogist 84 (1999) 130-137
Comparative high-pressure crystal chemistry of karrooite, MgTi2O5, with
different ordering states
Sample P1400, x(Ti) in M1 = .485, P = 3.22 GPa
_database_code_amcsd 0002083
9.6949 9.9022 3.7313 90 90 90 Bbmm
atom     x     y z   occ Biso
Mg1  .8078   .25 0  .515  .51
Ti1  .8078   .25 0  .485  .51
Ti2  .1358 .4368 0 .7575  .57
Mg2  .1358 .4368 0 .2425  .57
O1   .2342   .25 0       1.14
O2   .0473 .8827 0        .94
O3   .3125 .9312 0        .80
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Pseudobrookite
Download hom/pseudobrookite.pdf
Yang H, Hazen R M
Download am/vol84/AM84_130.pdf
American Mineralogist 84 (1999) 130-137
Comparative high-pressure crystal chemistry of karrooite, MgTi2O5, with
different ordering states
Sample P1400, x(Ti) in M1 = .485, P = 4.34 GPa
_database_code_amcsd 0002084
9.6737 9.8769 3.7271 90 90 90 Bbmm
atom     x     y z   occ Biso
Mg1  .8074   .25 0  .515  .49
Ti1  .8074   .25 0  .485  .49
Ti2  .1357 .4367 0 .7575  .48
Mg2  .1357 .4367 0 .2425  .48
O1   .2339   .25 0        .89
O2   .0474 .8828 0        .68
O3   .3123 .9307 0        .70
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Pseudobrookite
Download hom/pseudobrookite.pdf
Yang H, Hazen R M
Download am/vol84/AM84_130.pdf
American Mineralogist 84 (1999) 130-137
Comparative high-pressure crystal chemistry of karrooite, MgTi2O5, with
different ordering states
Sample P1400, x(Ti) in M1 = .485, P = 6.20 GPa
_database_code_amcsd 0002085
9.6327 9.8302 3.7177 90 90 90 Bbmm
atom     x     y z   occ Biso
Mg1  .8072   .25 0  .515  .49
Ti1  .8072   .25 0  .485  .49
Ti2  .1358 .4365 0 .7575  .53
Mg2  .1358 .4365 0 .2425  .53
O1   .2344   .25 0        .71
O2   .0474 .8829 0        .66
O3   .3128 .9310 0        .69
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Pseudobrookite
Download hom/pseudobrookite.pdf
Yang H, Hazen R M
Download am/vol84/AM84_130.pdf
American Mineralogist 84 (1999) 130-137
Comparative high-pressure crystal chemistry of karrooite, MgTi2O5, with
different ordering states
Sample P1400, x(Ti) in M1 = .485, P = 7.51 GPa
_database_code_amcsd 0002086
9.6080 9.8024 3.7114 90 90 90 Bbmm
atom     x     y z   occ Biso
Mg1  .8066   .25 0  .515  .56
Ti1  .8066   .25 0  .485  .56
Ti2  .1357 .4367 0 .7575  .54
Mg2  .1357 .4367 0 .2425  .54
O1   .2354   .25 0        .74
O2   .0471 .8821 0        .82
O3   .3137 .9310 0        .66
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Pseudobrookite
Download hom/pseudobrookite.pdf
Pauling L
 
Zeitschrift fur Kristallographie 73 (1930) 97-113
The crystal structure of pseudobrookite
_cod_database_code 1011342
_database_code_amcsd 0018179
3.725 9.79 9.93 90 90 90 Cmcm
atom x    y    z
Ti1  0  .19  .25
Fe1  0 .135  .56
O1   0  .73  .25
O2   0 .045  .11
O3   0  .31 .095
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
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Total number of retrieved datasets: 15
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