American Mineralogist Crystal Structure Database

1 matching records for this search.

Inesite
Download hom/inesite.pdf
Wan C, Ghose S
Download am/vol63/AM63_563.pdf
American Mineralogist 63 (1978) 563-571
Inesite, a hydrated calcium manganese silicate with five-tetrahedral-repeat
double chains
_database_code_amcsd 0000669
8.889 9.247 11.975 88.15 132.07 96.64 P-1
atom      x      y      z  occ Biso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Ca   .38823 .26154 .10164            .0205  .0120  .0075  .0042  .0073  .0007
Mn1       0      0      0            .0111  .0139  .0084  .0013  .0066  .0007
Mn2  .09978 .07665 .77404            .0093  .0096  .0083  .0016  .0066  .0006
Mn3  .20633 .11273 .55863            .0086  .0124  .0086  .0008  .0065  .0001
Mn4  .30756 .15973 .33874            .0087  .0218  .0085  .0000  .0066  .0003
Si1  .13271 .72738 .77309            .0076  .0077  .0065  .0009  .0056  .0004
Si2  .21219 .75524 .55699            .0083  .0090  .0081  .0012  .0066  .0005
Si3  .01735 .60119 .26428            .0109  .0080  .0087  .0004  .0079  .0004
Si4  .31748 .81419 .28134            .0069  .0103  .0071  .0011  .0052  .0012
Si5  .40405 .88778 .08109            .0069  .0097  .0060  .0013  .0049  .0005
O1    .6530  .2168  .0560            .0092  .0124  .0078  .0018  .0055 -.0006
O2    .9568  .4283  .2119            .0204  .0074  .0167 -.0014  .0156 -.0009
O3    .0265  .1558  .3087            .0084  .0107  .0106  .0028  .0069  .0018
O4    .7920  .3069  .3140            .0154  .0153  .0099  .0052  .0106  .0032
O5    .9267  .1140  .5295            .0102  .0110  .0103  .0020  .0076  .0017
O6    .8988  .3865  .5653            .0221  .0113  .0114  .0008  .0128 -.0003
O7    .5515  .2071  .3509            .0112  .0229  .0189  .0017  .0111  .0035
O8    .1636  .3038  .8471            .0116  .0127  .0144  .0036  .0079  .0006
O9    .7826  .3452  .7148            .0135  .0108  .0192  .0007  .0133  .0029
O10   .8280  .0630  .7639            .0098  .0126  .0121  .0027  .0080  .0011
O11   .6840  .2144  .8542            .0129  .0147  .0117 -.0005  .0103  .0008
O12   .4512  .1449  .5644            .0075  .0228  .0089  .0003  .0058  .0001
O13   .2728  .0236  .0080            .0123  .0127  .0105  .0043  .0081  .0019
O14   .3535  .0736  .7880            .0071  .0167  .0092  .0015  .0058  .0007
Oh    .1332  .2161  .1074            .0133  .0167  .0137  .0043  .0098  .0021
OW1   .2640  .3600  .5957            .0222  .0174  .0287  .0031  .0100 -.0008
OW2   .5498  .4905  .8799            .1407  .0357  .0220  .0439 -.0072 -.0054
OW3   .4024  .4159  .4399 .478       .0234  .0232  .0315  .0102  .0153  .0132
H1     .025   .281   .064       4.0
H2     .127   .373   .528       4.0
H3     .315   .379   .544       4.0
H4     .640   .433   .950       4.0
H5     .483   .433   .788       4.0
H6     .553   .413   .527 .478  4.0
H7     .348   .466   .363 .478  4.0
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