American Mineralogist Crystal Structure Database

1 matching records for this search.

Ba1.14 K0.72 S4 V
 
Vincent H, Anne M, Chang A, Marcus J
 
Journal of Solid State Chemistry 61 (1986) 332-337
Synthese et structure cristalline de Ba1.14 K.72 V S4
_cod_database_code 1008319
_database_code_amcsd 0016234
9.158 12.144 6.729 90 90 90 Pna2_1
atom      x      y      z occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Ba1  .02618 .33022    .25      .0163  .0158  .0255  .0015  .0055  .0065
K1    .3585  .5954  .2560 .72  .0257  .0553  .0314 -.0078  .0015  .0032
Ba2   .3585  .5954  .2560 .14  .0257  .0553  .0314 -.0078  .0015  .0032
V1   .76319 .57831  .2548      .0127  .0145  .0157  .0009  .0042  .0033
S1   -.0016  .5950  .2468      .0144  .0219  .0322 -.0029  .0013  .0065
S2    .1971  .0921  .2458      .0196  .0170  .0313  .0039 -.0008  .0111
S3    .3291  .3439  .0053      .0148  .0344  .0255  .0080  .0006  .0126
S4    .1758  .8431 -.0014      .0436  .0457  .0216 -.0116 -.0002 -.0136
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