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American Mineralogist Crystal Structure Database

1 matching records for this search.

Clinopyribole
  
Yang H, Konzett J, Prewitt C T
Download am/vol86/AM86_1261.pdf 
American Mineralogist 86 (2001) 1261-1266
Crystal structure of a new (21)-clinopyribole synthesized at high temperature and pressure
_database_code_amcsd 0002726
9.8390 26.6471 5.2665 90 106.25 90 A2/m
atom      x     y      z occ Biso B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3)
MgS1     .5 .2188     .5 .44       .0019  .0003  .0069      0  .0015      0
AlS1     .5 .2188     .5 .56       .0019  .0003  .0069      0  .0015      0
CaS2     .5 .3482     .5 .55       .0040  .0004  .0120      0 -.0003      0
NaS2     .5 .3482     .5 .45       .0040  .0004  .0120      0 -.0003      0
SiS   .7817 .2800  .4774           .0021  .0003  .0065  .0000  .0011 -.0001
OS1   .6110 .2751  .3820           .0026  .0006  .0114  .0000  .0011 -.0007
OS2   .8527 .3330  .5653           .0047  .0003  .0136 -.0002  .0039 -.0004
OS3   .8460 .2438  .7430           .0024  .0004  .0089 -.0001  .0016  .0003
MgD1      0 .4398      0           .0025  .0003  .0071      0  .0017      0
MgD2      0 .1205      0 .95       .0023  .0003  .0084      0  .0009      0
AlD2      0 .1205      0 .05       .0023  .0003  .0084      0  .0009      0
MgD3      0     0      0           .0022  .0003  .0072      0  .0010      0
CaD4      0 .3132      0 .21       .0033  .0004  .0100      0  .0004      0
NaD4      0 .3132      0 .71       .0033  .0004  .0100      0  .0004      0
KD4       0 .3132      0 .05       .0033  .0004  .0100      0  .0004      0
Mg4       0 .3132      0 .03       .0033  .0004  .0100      0  .0004      0
SiD1 -.2792 .0579  .0241           .0019  .0003  .0057  .0000  .0010  .0000
SiD2  .2898 .1168  .4803           .0018  .0003  .0070  .0000  .0011  .0000
OD1  -.1103 .0584  .1085           .0020  .0003  .0092  .0001  .0020  .0001
OD2   .1194 .1160  .3919           .0019  .0003  .0075  .0000  .0008  .0003
OD3   .1092     0  .3937           .0025  .0004  .0100      0  .0011      0
OD4   .3690 .1687  .5554           .0037  .0004  .0130 -.0003  .0025 -.0002
OD5   .3486 .0860  .2565           .0022  .0004  .0092 -.0001  .0004 -.0003
OD6  -.6554 .0809 -.2498           .0020  .0005  .0095  .0000  .0022  .0003
OD7  -.3366     0 -.0200           .0026  .0003  .0104      0  .0009      0
KAD      .5     0     .5           .0082  .0005  .0204      0 -.0064      0
HD     .200     0   .461      2.1


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