American Mineralogist Crystal Structure Database

8 matching records for this search.

Titanite
Download hom/titanite.pdf
Troitzsch U, Ellis D J, Thompson J, Fitz-Gerald J
 
European Journal of Mineralogy 11 (1999) 955-965
Crystal structural changes in titanite along the join TiO-AlF
Sample: AlF09
_database_code_amcsd 0006799
7.0541 8.6925 6.5445 90 113.903 90 A2/a
atom      x     y     z  occ Biso
Ca      .25 .1666     0      1.94
Aloct    .5     0    .5 .099 1.98
Tioct    .5     0    .5 .901 1.98
Si      .75 .1846     0      1.62
O1      .75 .0666    .5 .901  .65
F1      .75 .0666    .5 .099  .65
O2    .9070 .0670 .1832       .65
O3    .3842 .2086 .4001       .65
Download AMC data (View Text File)
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Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Titanite
Download hom/titanite.pdf
Troitzsch U, Ellis D J, Thompson J, Fitz-Gerald J
 
European Journal of Mineralogy 11 (1999) 955-965
Crystal structural changes in titanite along the join TiO-AlF
Sample: AlF18
_database_code_amcsd 0006800
7.0511 8.6722 6.5325 90 114.026 90 A2/a
atom      x     y     z  occ Biso
Ca      .25 .1659     0      1.77
Aloc     .5     0    .5 .182 1.64
Tioct    .5     0    .5 .818 1.64
Si      .75 .1833     0       .93
O1      .75 .0689    .5 .818  .09
F1      .75 .0689    .5 .182  .09
O2    .9096 .0664 .1849       .09
O3    .3853 .2088 .3989       .09
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Titanite
Download hom/titanite.pdf
Troitzsch U, Ellis D J, Thompson J, Fitz-Gerald J
 
European Journal of Mineralogy 11 (1999) 955-965
Crystal structural changes in titanite along the join TiO-AlF
Sample: AlF29
_database_code_amcsd 0006801
7.0462 8.6529 6.5231 90 114.143 90 A2/a
atom      x     y     z  occ Biso
Ca      .25 .1652     0      1.85
Aloct    .5     0    .5 .291 1.75
Tioct    .5     0    .5 .709 1.75
Si      .75 .1834     0      1.59
O1      .75 .0674    .5 .709  .49
F1      .75 .0674    .5 .291  .49
O2    .9071 .0669 .1852       .49
O3    .3821 .2103 .3993       .49
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Titanite
Download hom/titanite.pdf
Troitzsch U, Ellis D J, Thompson J, Fitz-Gerald J
 
European Journal of Mineralogy 11 (1999) 955-965
Crystal structural changes in titanite along the join TiO-AlF
Sample: AlF37
_database_code_amcsd 0006802
7.0368 8.6360 6.5135 90 114.232 90 A2/a
atom      x     y     z  occ Biso
Ca      .25 .1651     0      1.28
Aloct    .5     0    .5 .372 1.59
Tioct    .5     0    .5 .628 1.59
Si      .75 .1837     0       .83
O1      .75 .0698    .5 .628  .38
F1      .75 .0698    .5 .372  .38
O2    .9030 .0654 .1850       .38
O3    .3796 .2083 .3948       .38
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Titanite
Download hom/titanite.pdf
Troitzsch U, Ellis D J, Thompson J, Fitz-Gerald J
 
European Journal of Mineralogy 11 (1999) 955-965
Crystal structural changes in titanite along the join TiO-AlF
Sample: AlF49
_database_code_amcsd 0006803
7.0229 8.6130 6.5023 90 114.344 90 A2/a
atom      x     y     z  occ Biso
Ca      .25 .1639     0      1.64
Aloct    .5     0    .5 .489 1.52
Tioct    .5     0    .5 .511 1.52
Si      .75 .1848     0      1.19
O1      .75 .0674    .5 .511  .50
F1      .75 .0674    .5 .489  .50
O2    .9052 .0673 .1885       .50
O3    .3838 .2057 .4017       .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)
 
Titanite
Download hom/titanite.pdf
Troitzsch U, Ellis D J, Thompson J, Fitz-Gerald J
 
European Journal of Mineralogy 11 (1999) 955-965
Crystal structural changes in titanite along the join TiO-AlF
Sample: AlF67
_database_code_amcsd 0006804
6.9904 8.5759 6.4798 90 114.480 90 A2/a
atom      x     y     z  occ Biso
Ca      .25 .1632     0      1.66
Aloct    .5     0    .5 .672 1.70
Tioct    .5     0    .5 .328 1.70
Si      .75 .1856     0      1.22
O1      .75 .0684    .5 .328  .81
F1      .75 .0684    .5 .672  .81
O2    .9036 .0650 .1893       .81
O3    .3850 .2049 .4045       .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)
 
Titanite
Download hom/titanite.pdf
Troitzsch U, Ellis D J, Thompson J, Fitz-Gerald J
 
European Journal of Mineralogy 11 (1999) 955-965
Crystal structural changes in titanite along the join TiO-AlF
Sample: AlF82
_database_code_amcsd 0006805
6.9580 8.5445 6.4612 90 114.585 90 A2/a
atom      x     y     z  occ Biso
Ca      .25 .1623     0      1.87
Aloct    .5     0    .5 .819 2.20
Tioct    .5     0    .5 .181 2.20
Si      .75 .1865     0      1.45
O1      .75 .0698    .5 .181  .95
F1      .75 .0698    .5 .819  .95
O2    .9028 .0624 .1901       .95
O3    .3845 .2028 .4049       .95
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Titanite
Download hom/titanite.pdf
Troitzsch U, Ellis D J, Thompson J, Fitz-Gerald J
 
European Journal of Mineralogy 11 (1999) 955-965
Crystal structural changes in titanite along the join TiO-AlF
Sample: AlF100
_database_code_amcsd 0006806
6.9157 8.5076 6.4391 90 114.683 90 A2/a
atom      x     y     z Biso
Ca      .25 .1642     0 1.34
Aloct    .5     0    .5 1.40
Si      .75 .1867     0 1.03
F1      .75 .0694    .5  .56
O2    .9048 .0662 .1877  .56
O3    .3898 .2020 .4054  .56
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: 8
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