American Mineralogist Crystal Structure Database

2 matching records for this search.

Omphacite
Download hom/omphacite.pdf
Curtis L, Gittins J, Kocman V, Rucklidge J C, Hawthorne F C, Ferguson R B
Download cm/vol13/CM13_62.pdf
The Canadian Mineralogist 13 (1975) 62-67
Two crystal structure refinements of a P2/n titanian ferro-omphacite
Sample: Tronto
_database_code_amcsd 0005103
9.622 8.826 5.279 90 106.92 90 P2/n
atom      x     y     z  occ B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3)
FeM1    .75 .6570   .25 .779  .0021  .0022  .0039      0  .0009      0
AlM1    .75 .6570   .25 .221  .0021  .0022  .0039      0  .0009      0
FeM11   .75 .8499   .75 .171  .0016  .0013  .0037      0  .0016      0
AlM11   .75 .8499   .75 .829  .0016  .0013  .0037      0  .0016      0
CaM2    .75 .0524   .25 .285  .0056  .0036  .0119      0  .0015      0
NaM2    .75 .0524   .25 .715  .0056  .0036  .0119      0  .0015      0
CaM21   .75 .4530   .75 .699  .0052  .0029  .0082      0  .0003      0
NaM21   .75 .4530   .75 .301  .0052  .0029  .0082      0  .0003      0
Si1   .0402 .8472 .2298       .0023  .0016  .0052  .0001  .0020 -.0002
Si2   .0381 .6651 .7354       .0019  .0019  .0045  .0000  .0015  .0000
O11   .8655 .8410 .1223       .0019  .0031  .0098  .0001  .0025 -.0003
O12   .8622 .6804 .6561       .0027  .0028  .0102  .0004  .0025 -.0006
O21   .1154 .0091 .3095       .0036  .0027  .0074 -.0007  .0018  .0000
O22   .1039 .5007 .8052       .0043  .0031  .0113  .0016  .0034  .0018
O31   .1077 .7660 .0082       .0038  .0032  .0060  .0001  .0021 -.0013
O32   .0969 .7430 .5019       .0024  .0034  .0082  .0002  .0021  .0007
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Omphacite
Download hom/omphacite.pdf
Curtis L, Gittins J, Kocman V, Rucklidge J C, Hawthorne F C, Ferguson R B
Download cm/vol13/CM13_62.pdf
The Canadian Mineralogist 13 (1975) 62-67
Two crystal structure refinements of a P2/n titanian ferro-omphacite
Sample: Winnipeg
_database_code_amcsd 0005104
9.622 8.826 5.279 90 106.92 90 P2/n
atom      x     y     z  occ B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3)
FeM1    .75 .6560   .25 .786  .0017  .0021  .0053      0  .0005      0
AlM1    .75 .6560   .25 .214  .0017  .0021  .0053      0  .0005      0
FeM11   .75 .8499   .75 .251  .0013  .0016  .0038      0  .0008      0
AlM11   .75 .8499   .75 .749  .0013  .0016  .0038      0  .0008      0
CaM2    .75 .0520   .25 .260  .0052  .0035  .0106      0  .0005      0
NaM2    .75 .0520   .25 .740  .0052  .0035  .0106      0  .0005      0
CaM21   .75 .4526   .75 .672  .0045  .0033  .0095      0 -.0003      0
NaM21   .75 .4526   .75 .328  .0045  .0033  .0095      0 -.0003      0
Si1   .0402 .8464 .2305       .0015  .0020  .0046  .0000  .0011  .0001
Si2   .0382 .6647 .7353       .0017  .0018  .0035  .0001  .0010  .0001
O11   .8646 .8400 .1227       .0017  .0030  .0053 -.0001  .0012 -.0001
O12   .8632 .6798 .6559       .0012  .0030  .0061 -.0003  .0012 -.0003
O21   .1156 .0088 .3088       .0022  .0019  .0077 -.0003  .0007 -.0004
O22   .1041 .5002 .8058       .0033  .0022  .0089  .0008  .0019  .0007
O31   .1072 .7661 .0102       .0018  .0027  .0067  .0003  .0010 -.0012
O32   .0972 .7428 .5024       .0020  .0027  .0033 -.0001  .0017  .0008
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: 2
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