|
Celsian |
 |
Griffen D T, Ribbe P H |
 |
American Mineralogist 61 (1976) 414-418 |
|
Refinement of the crystal structure of celsian |
|
_database_code_amcsd 0000519 |
|
8.622 13.078 14.411 90 115.1 90 I2/c |
|
atom x y z occ B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3) |
|
Ba1 .2827 0 .0653 .0028 .0014 .0019 -.0001 .0007 -.0001 |
|
Al1 .0096 .1820 .1103 .5 .0028 .0009 .0012 -.0001 .0008 -.0001 |
|
Si1 .0096 .1820 .1103 .5 .0028 .0009 .0012 -.0001 .0008 -.0001 |
|
Al2 .0076 .1830 .6148 .5 .0013 .0007 .0008 -.0004 .0002 .0000 |
|
Si2 .0076 .1830 .6148 .5 .0013 .0007 .0008 -.0004 .0002 .0000 |
|
Al3 .7054 .1214 .1730 .5 .0022 .0004 .0009 .0003 .0005 .0001 |
|
Si3 .7054 .1214 .1730 .5 .0022 .0004 .0009 .0003 .0005 .0001 |
|
Al4 .7019 .1163 .6743 .5 .0016 .0007 .0010 -.0001 .0004 .0001 |
|
Si4 .7019 .1163 .6743 .5 .0016 .0007 .0010 -.0001 .0004 .0001 |
|
O1 .0005 .1377 -.0002 .0047 .0005 .0008 -.0005 .0006 .0000 |
|
O2 .6206 -.0003 .1438 .0031 .0002 .0022 .0008 .0005 .0004 |
|
O3 .8349 .1368 .1119 .0064 .0015 .0027 -.0011 .0022 -.0002 |
|
O4 .8198 .1370 .6136 .0039 .0009 .0016 .0004 .0004 -.0001 |
|
O5 .0220 .3062 .1210 .0055 .0009 .0022 -.0003 .0012 .0001 |
|
O6 .0293 .3120 .6312 .0024 .0019 .0022 -.0001 .0016 .0004 |
|
O7 .1836 .1296 .1958 .0038 .0019 .0017 -.0002 .0006 -.0003 |
|
O8 .1900 .1231 .7017 .0041 .0022 .0016 .0008 .0012 .0003 |
|
|
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| |
|
Slawsonite |
|
Griffen D T, Ribbe P H, Gibbs G V |
|
American Mineralogist 62 (1977) 31-35 |
|
The structure of slawsonite, a strontium analog of paracelsian |
|
_database_code_amcsd 0000553 |
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8.888 9.344 8.326 90 90.33 90 P2_1/a |
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atom x y z occ B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3) |
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Sr .8902 .4122 .2503 .87 .0030 .0020 .0029 .0000 .0000 .0001 |
|
Ca .8902 .4122 .2503 .13 .0030 .0020 .0029 .0000 .0000 .0001 |
|
Si1o .2321 .9249 .9311 .50 .0009 .0010 .0012 .0001 .0000 .0002 |
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Al1o .2321 .9249 .9311 .50 .0009 .0010 .0012 .0001 .0000 .0002 |
|
Si1m .2405 .9199 .5605 .50 .0006 .0009 .0011 .0000 .0002 .0000 |
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Al1m .2405 .9199 .5605 .50 .0006 .0009 .0011 .0000 .0002 .0000 |
|
Si2o .0595 .2006 .9440 .50 .0008 .0006 .0010 -.0002 .0000 .0001 |
|
Al2o .0595 .2006 .9440 .50 .0008 .0006 .0010 -.0002 .0000 .0001 |
|
Si2m .0541 .1944 .5706 .50 .0009 .0007 .0010 -.0001 .0001 .0000 |
|
Al2m .0541 .1944 .5706 .50 .0009 .0007 .0010 -.0001 .0001 .0000 |
|
O1o .1910 .0934 .0100 .0021 .0015 .0022 .0007 .0003 .0000 |
|
O1m .1875 .0740 .4937 .0025 .0010 .0028 .0008 .0008 .0005 |
|
O2o .1192 .3658 .9458 .0013 .0007 .0022 -.0002 -.0007 .0003 |
|
O2m .1236 .3699 .5573 .0017 .0012 .0020 -.0001 .0011 -.0002 |
|
O3o .9202 .1919 .0699 .0013 .0016 .0015 -.0002 .0003 -.0002 |
|
O3m .8979 .1923 .4399 .0010 .0016 .0029 .0000 .0001 .0004 |
|
O4 .0092 .1545 .7662 .0042 .0027 .0013 -.0012 .0000 .0000 |
|
O5 .3139 .9252 .7407 .0012 .0025 .0017 -.0006 .0003 .0002 |
|
|
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| |
|
Microcline |
|
Griffen D T, Johnson B T |
| |
American Mineralogist 69 (1984) 1072-1077 |
|
Strain in triclinic alkali feldspars: a crystal structure study |
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intermediate |
|
_database_code_amcsd 0000962 |
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8.552 12.975 7.205 90.09 115.92 89.51 C-1 |
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atom x y z occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
Al(1o) .0096 .1850 .2229 .54 .0220 .0149 .0135 -.0032 .0083 -.0015 |
|
Si(1o) .0096 .1850 .2229 .46 .0220 .0149 .0135 -.0032 .0083 -.0015 |
|
Si(1m) .0093 .8165 .2260 .68 .0211 .0139 .0131 .0018 .0083 .0018 |
|
Al(1m) .0093 .8165 .2260 .32 .0211 .0139 .0131 .0018 .0083 .0018 |
|
Si(2o) .7086 .1183 .3434 .93 .0191 .0105 .0127 -.0005 .0068 .0003 |
|
Al(2o) .7086 .1183 .3434 .07 .0191 .0105 .0127 -.0005 .0068 .0003 |
|
Si(2m) .7074 .8829 .3459 .93 .0191 .0105 .0131 -.0009 .0068 .0000 |
|
Al(2m) .7074 .8829 .3459 .07 .0191 .0105 .0131 -.0009 .0068 .0000 |
|
K .2838 .9985 .1366 .89 .0189 .0254 .0214 .0000 .0058 -.0001 |
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Na .2838 .9985 .1366 .11 .0189 .0254 .0214 .0000 .0058 -.0001 |
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O(A1) .9999 .1442 .9959 .0325 .0176 .0231 .0004 .0128 .0007 |
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O(A2) .6352 .0012 .2851 .0285 .0130 .0214 -.0008 .0048 .0003 |
|
O(Bo) .8255 .1453 .2263 .0295 .0323 .0264 -.0036 .0182 .0014 |
|
O(Bm) .8273 .8552 .2301 .0303 .0322 .0288 .0036 .0186 .0001 |
|
O(Co) .0344 .3129 .2579 .0248 .0185 .0229 -.0032 .0088 -.0032 |
|
O(Cm) .0353 .6902 .2616 .0252 .0198 .0230 .0027 .0099 .0044 |
|
O(Do) .1842 .1251 .4064 .0291 .0207 .0126 .0004 .0042 .0014 |
|
O(Dm) .1809 .8741 .4077 .0283 .0200 .0131 -.0020 .0037 -.0011 |
|
|
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|
| |
|
Dumortierite |
|
Alexander V D, Griffen D T, Martin T J |
|
American Mineralogist 71 (1986) 786-794 |
|
Crystal chemistry of some Fe- and Ti-poor dumortierites |
|
Sample: #2, BYU 12-5027, from Yuma Co., Arizona, USA |
|
_database_code_amcsd 0001022 |
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11.786 20.209 4.692 90 90 90 Pmcn |
|
atom x y z occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
Si1 .75 .4053 .0877 .0042 .0114 .0031 0 0 .0009 |
|
Si2 .5240 .3281 .5876 .99 .0082 .0070 .0032 -.0004 .0004 .0003 |
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Al1 .75 .2502 .3981 .93 .0067 .0122 .0836 0 0 -.0043 |
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Al2 .6103 .4722 .5573 .98 .0044 .0058 .0026 .0003 -.0003 -.0004 |
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Al3 .4913 .4307 .0595 .97 .0044 .0048 .0018 -.0006 .0000 .0001 |
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Al4 .3581 .2893 .0578 .99 .0073 .0075 .0053 .0011 -.0005 -.0002 |
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B .25 .4159 .2284 .0030 .0012 .0114 0 0 .0003 |
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O1 .75 .4537 .3788 .0058 .0213 .0060 0 0 -.0038 |
|
O2 .75 .3258 .1488 .0102 .0216 .0099 0 0 .0024 |
|
O3 .6390 .4242 .8967 .0076 .0171 .0045 -.0006 .0002 .0022 |
|
O4 .4364 .2824 .4014 .0104 .0143 .0054 -.0025 .0021 -.0018 |
|
O5 .5496 .3933 .3972 .0135 .0070 .0061 -.0009 -.0015 .0005 |
|
O6 .4537 .3504 .8846 .0137 .0093 .0066 -.0021 .0030 -.0018 |
|
O7 .6396 .2868 .6479 .0154 .0129 .0091 .0016 -.0023 .0009 |
|
O8 .25 .3500 .1685 .0038 .0102 .0212 0 0 -.0032 |
|
O9 .3507 .4482 .2553 .0059 .0109 .0119 -.0041 .0011 -.0021 |
|
O10 .25 .2723 .7603 .0048 .0145 .0060 0 0 -.0022 |
|
O11 .4663 .4881 .7505 .0057 .0072 .0047 .0006 .0004 .0000 |
|
|
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|
| |
|
Dumortierite |
|
Alexander V D, Griffen D T, Martin T J |
|
American Mineralogist 71 (1986) 786-794 |
|
Crystal chemistry of some Fe- and Ti-poor dumortierites |
|
Sample: #7, BYU 12-5119, from Virgin Mtns., Nevada, USA |
|
O5y and O11x have been editted |
|
_database_code_amcsd 0001023 |
|
11.798 20.210 4.710 90 90 90 Pmcn |
|
atom x y z occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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Si1 .75 .4053 .0871 .0027 .0102 .0029 0 0 .0001 |
|
Si2 .5243 .3283 .5870 .0066 .0056 .0036 -.0016 .0000 .0004 |
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Al1 .75 .2498 .3997 .84 .0050 .0073 .0492 0 0 -.0002 |
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Al2 .6104 .4725 .5580 .0029 .0045 .0035 -.0002 -.0003 -.0004 |
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Al3 .4911 .4311 .0595 .0036 .0047 .0029 -.0001 .0001 .0000 |
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Al4 .3586 .2891 .0576 .0047 .0063 .0058 .0014 -.0001 -.0011 |
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B .25 .4160 .2251 .0051 .0053 .0052 0 0 -.0009 |
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O1 .75 .4540 .3771 .0056 .0131 .0066 0 0 -.0017 |
|
O2 .75 .3265 .1498 .0145 .0184 .0138 0 0 .0047 |
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O3 .6394 .4243 .8963 .0057 .0105 .0055 .0005 -.0003 .0003 |
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O4 .4359 .2827 .4011 .0077 .0110 .0067 -.0018 -.0007 .0005 |
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O5 .5500 .3933 .3963 .0072 .0088 .0061 -.0003 -.0006 .0002 |
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O6 .4539 .3502 .8805 .0100 .0107 .0077 -.0017 .0006 -.0007 |
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O7 .6385 .2870 .6477 .0138 .0158 .0145 .0006 -.0042 .0026 |
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O8 .25 .3505 .1621 .0059 .0101 .0146 0 0 -.0029 |
|
O9 .3511 .4479 .2548 .0058 .0096 .0094 -.0004 .0004 -.0019 |
|
O10 .25 .2724 .7612 .0082 .0143 .0073 0 0 -.0016 |
|
O11 .4664 .4881 .7499 .0046 .0080 .0049 .0002 .0000 -.0002 |
|
|
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|
| |
|
Dumortierite |
|
Alexander V D, Griffen D T, Martin T J |
|
American Mineralogist 71 (1986) 786-794 |
|
Crystal chemistry of some Fe- and Ti-poor dumortierites |
|
Sample: #10, USNM 96698, from Petaca, New Mexco, USA |
|
_database_code_amcsd 0001024 |
|
11.800 20.222 4.699 90 90 90 Pmcn |
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atom x y z occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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Si1 .75 .4055 .0881 .0024 .0132 .0054 0 0 .0000 |
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Si2 .5237 .3282 .5875 .99 .0058 .0089 .0057 -.0005 .0002 -.0002 |
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Al1 .75 .2497 .3993 .91 .0031 .0100 .0824 0 0 -.0013 |
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Al2 .6104 .4722 .5582 .98 .0023 .0076 .0054 .0006 .0002 -.0001 |
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Al3 .491 .4308 .0599 .98 .0029 .0078 .0041 -.0010 .0002 .0001 |
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Al4 .3577 .2892 .0577 .99 .0051 .0096 .0085 .0008 .0008 -.0008 |
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B .25 .4153 .2325 .98 .0001 .0105 .0042 0 0 .0003 |
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O1 .75 .4532 .3791 .0061 .0183 .0075 0 0 -.0044 |
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O2 .75 .3267 .1503 .0078 .0173 .0137 0 0 .0027 |
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O3 .6387 .4249 .8964 .0067 .0163 .0063 -.0025 -.0017 .0032 |
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O4 .4355 .2821 .3997 .0079 .0175 .0089 .0008 .0005 -.0002 |
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O5 .5491 .3933 .3969 .0107 .0105 .0054 .0024 -.0012 .0015 |
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O6 .4544 .3505 .8827 .0114 .0123 .0081 -.0020 .0022 -.0024 |
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O7 .6387 .2868 .6484 .0108 .0175 .0129 .0028 -.0035 .0010 |
|
O8 .25 .3506 .1701 .0001 .0092 .0281 0 0 -.0007 |
|
O9 .3511 .4486 .2553 .0037 .0122 .0179 -.0008 .0009 -.0032 |
|
O10 .25 .2724 .7615 .0051 .0159 .0057 0 0 -.0011 |
|
O11 .4661 .4881 .7512 .0036 .0139 .0044 -.0018 .0009 .0012 |
|
|
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|
| |
|
Dumortierite |
|
Alexander V D, Griffen D T, Martin T J |
|
American Mineralogist 71 (1986) 786-794 |
|
Crystal chemistry of some Fe- and Ti-poor dumortierites |
|
Sample: #11, USNM 141800, from Ambositra, Madagascar |
|
_database_code_amcsd 0001025 |
|
11.802 20.222 4.695 90 90 90 Pmcn |
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atom x y z occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
Si1 .75 .4057 .0873 .99 .0024 .0084 .0027 0 0 .0002 |
|
Si2 .5246 .3282 .5873 .98 .0052 .0042 .0033 -.0012 .0002 .0002 |
|
Al1 .75 .2498 .3973 .85 .0079 .0119 .0547 0 0 -.0005 |
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Al2 .6102 .4725 .5580 .98 .0028 .0038 .0032 -.0005 .0001 -.0002 |
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Al3 .4910 .4310 .0597 .97 .0024 .0034 .0029 .0000 .0000 -.0003 |
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Al4 .3585 .2890 .0576 .99 .0048 .0059 .0065 .0011 -.0005 -.0016 |
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B .25 .4156 .2267 .0066 .0072 .0064 0 0 .0026 |
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O1 .75 .4539 .3765 .0040 .0134 .0077 0 0 -.0020 |
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O2 .75 .3259 .1494 .0150 .0159 .0113 0 0 .0042 |
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O3 .6397 .4241 .8953 .0064 .0115 .0062 .0008 .0006 .0008 |
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O4 .4362 .2825 .3994 .0065 .0107 .0077 -.0020 -.0015 .0003 |
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O5 .5504 .3933 .3956 .0069 .0086 .0073 -.0007 -.0003 -.0005 |
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O6 .4539 .3501 .8807 .010 .0103 .0073 -.0032 .0005 -.0008 |
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O7 .6397 .2867 .6478 .0136 .0155 .0130 .0014 -.0025 .0012 |
|
O8 .25 .3502 .1623 .0078 .0081 .0116 0 0 -.0022 |
|
O9 .3511 .4480 .2540 .0059 .0127 .0101 -.0012 .0011 -.0020 |
|
O10 .25 .2723 .7614 .0082 .0154 .0072 0 0 -.0011 |
|
O11 .4661 .4881 .7503 .0067 .0099 .0054 -.0007 .0007 -.0002 |
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|
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|
| |
|
Staurolite |
|
Bringhurst K N, Griffen D T |
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American Mineralogist 71 (1986) 1466-1472 |
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Staurolite-lusakite series. II. Crystal structure and optical properties of a |
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cobaltoan staurolite |
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Note: a-cell parameter corrected by Griffen, Aug 2001. |
|
_database_code_amcsd 0001058 |
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7.872 16.608 5.648 90 90.04 90 C2/m |
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atom x y z occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
Fe .3909 0 .2495 .408 .0162 .0057 .0233 0 .0002 0 |
|
Al .3909 0 .2495 .36 .0162 .0057 .0233 0 .0002 0 |
|
Co .3909 0 .2495 .138 .0162 .0057 .0233 0 .0002 0 |
|
Ti .3909 0 .2495 .032 .0162 .0057 .0233 0 .0002 0 |
|
Zn .3909 0 .2495 .01 .0162 .0057 .0233 0 .0002 0 |
|
Si .1342 .1663 .2496 .932 .0024 .0023 .0041 .0001 .0002 .0000 |
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Al .1342 .1663 .2496 .055 .0024 .0023 .0041 .0001 .0002 .0000 |
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Al1A .5 .1747 0 .888 .0026 .0029 .0025 0 .0001 0 |
|
Mg1A .5 .1747 0 .08 .0026 .0029 .0025 0 .0001 0 |
|
Al1B .5 .1747 .5 .888 .0024 .0029 .0021 0 .0004 0 |
|
Mg1B .5 .1747 .5 .078 .0024 .0029 .0021 0 .0004 0 |
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Al2 .2633 .4103 .2504 .0038 .0039 .0071 .0001 .0001 .0001 |
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Al3A 0 0 0 .28 .0047 .0043 .0079 0 .0024 0 |
|
Mg3A 0 0 0 .15 .0047 .0043 .0079 0 .0024 0 |
|
Fe3A 0 0 0 .05 .0047 .0043 .0079 0 .0024 0 |
|
Al3B 0 0 .5 .20 .0033 .0037 .0082 0 -.0026 0 |
|
Mg3B 0 0 .5 .15 .0033 .0037 .0082 0 -.0026 0 |
|
Fe3B 0 0 .5 .05 .0033 .0037 .0082 0 -.0026 0 |
|
FeU1 .5 0 0 .06 .0135 |
|
MnU1 .5 0 0 .01 .0135 |
|
FeU2 .5 0 .5 .05 .0117 |
|
MnU2 .5 0 .5 .01 .0117 |
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OH1A .2345 0 .9642 .0127 .0063 .0125 0 .0031 0 |
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O1B .2351 0 .5356 .0134 .0065 .0116 0 -.0025 0 |
|
O2A .2550 .1614 .0152 .0059 .0079 .0081 -.0007 .0006 -.0002 |
|
O2B .2547 .1614 .4839 .0056 .0079 .0076 -.0007 .0002 .0004 |
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O3 .0015 .0891 .2488 .0056 .0067 .0150 .0006 .0000 -.0001 |
|
O4 .0211 .2493 .2498 .0071 .0059 .0075 .0010 .0001 .0001 |
|
O5 .5271 .0993 .2499 .0054 .0064 .0069 -.0003 -.0001 .0002 |
|
|
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|
| |
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Howlite |
|
Griffen D T |
|
American Mineralogist 73 (1988) 1138-1144 |
|
Howlite, Ca2SiB5O9(OH)5: Structure refinement and hydrogen bonding |
|
_database_code_amcsd 0001197 |
|
12.820 9.351 8.608 90 104.84 90 P2_1/c |
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atom x y z Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
Ca1 .11738 .18339 .14917 .0080 .0080 .0091 -.0008 .0026 -.0006 |
|
Ca2 .41192 .82088 .52253 .0071 .0088 .0101 .0010 .0023 .0016 |
|
Si .14127 .55510 .01101 .0054 .0055 .0054 .0003 .0018 -.0001 |
|
B1 .0371 .4728 .2559 .0061 .0078 .0066 .0004 .0015 -.0003 |
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B2 .3226 .3834 .0268 .0061 .0070 .0064 .0001 .0012 .0000 |
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B3 .4927 .4209 .2508 .0073 .0073 .0089 .0002 .0019 .0010 |
|
B4 .3425 .2623 .2862 .0074 .0074 .0080 -.0001 .0022 .0004 |
|
B5 .1573 .6489 .4697 .0072 .0069 .0077 -.0005 .0014 -.0006 |
|
O1 .0803 .5138 -.1738 .0059 .0117 .0067 .0003 .0006 -.0015 |
|
O2 .1251 .7217 .0502 .0146 .0058 .0108 .0021 .0062 .0015 |
|
O3 .0992 .4525 .1349 .0098 .0078 .0093 .0008 .0058 .0009 |
|
O4 .2687 .5237 .0306 .0057 .0065 .0101 .0006 .0017 -.0004 |
|
O5 .0614 .5997 .3529 .0075 .0078 .0095 .0001 .0008 -.0025 |
|
O6 .4387 .4088 .0801 .0054 .0110 .0064 -.0002 .0011 .0007 |
|
O7 .2914 .1692 .3631 .0086 .0106 .0064 -.0020 .0011 .0019 |
|
O8 .2870 .2812 .1290 .0080 .0096 .0086 -.0022 .0012 .0025 |
|
O9 .4372 .3332 .3539 .0076 .0093 .0076 -.0021 .0017 .0004 |
|
O10 .4964 .5711 .2940 .0175 .0087 .0134 -.0019 .0016 -.0008 |
|
O11 .6014 .3568 .2724 .0058 .0115 .0130 -.0006 .0008 .0014 |
|
O12 .2477 .6851 .3994 .0104 .0156 .0106 -.0037 .0046 -.0016 |
|
O13 .1975 .5421 .5987 .0122 .0104 .0118 -.0005 .0007 .0039 |
|
O14 .0549 .3363 .3524 .0087 .0083 .0088 -.0007 .0022 .0021 |
|
H10 .534 .593 .385 .0371 |
|
H11 .345 .598 .681 .0308 |
|
H12 .225 .685 .298 .0522 |
|
H13 .185 .574 -.308 .0367 |
|
H14 .007 .704 -.342 .0258 |
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|
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Garnet |
| |
Griffen D T, Hatch D M, Phillips W R, Kulaksiz S |
|
American Mineralogist 77 (1992) 399-406 |
|
Crystal chemistry and symmetry of a birefringent tetragonal |
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pyralspite75-grandite25 garnet |
|
_database_code_amcsd 0001447 |
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11.6207 11.6207 11.6230 90 90 90 *I4_1/acd |
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.5 .25 .125 |
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atom x y z occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
Fe1 .1249 0 .25 .63 0.0076 0.0134 0.0130 0 0 0.0012 |
|
Ca1 .1249 0 .25 .25 0.0076 0.0134 0.0130 0 0 0.0012 |
|
Mg1 .1249 0 .25 .08 0.0076 0.0134 0.0130 0 0 0.0012 |
|
Mn1 .1249 0 .25 .03 0.0076 0.0134 0.0130 0 0 0.0012 |
|
Fe2 0 .25 .125 .63 0.0128 0.0128 0.0068 0.0016 0 0 |
|
Ca2 0 .25 .125 .25 0.0128 0.0128 0.0068 0.0016 0 0 |
|
Mg2 0 .25 .125 .08 0.0128 0.0128 0.0068 0.0016 0 0 |
|
Mn2 0 .25 .125 .03 0.0128 0.0128 0.0068 0.0016 0 0 |
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AlY 0 0 0 0.0081 0.0084 0.0083 0.0001 -.0006 -.0005 |
|
Si1 .3749 0 .25 0.0106 0.0091 0.0089 0 0 -.0001 |
|
Si3 0 .25 .375 0.0086 0.0086 0.0111 0 0 0 |
|
O1 .2848 .0973 .2025 0.0126 0.0126 0.0116 0.0009 -.0020 0.0001 |
|
O2 .0977 .2024 .2851 0.0114 0.0114 0.0133 0.0010 0.0002 -.0009 |
|
O3 .2024 .2847 .0976 0.0136 0.0118 0.0113 -.0005 0.0007 0.0001 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Rhodonite |
|
Nelson W R, Griffen D T |
|
American Mineralogist 90 (2005) 969-983 |
|
Crystal chemistry of Zn-rich rhodonite ("fowlerite") |
|
Sample: 15-4018 |
|
Note: see samples 15-4029 and 15-4024 for plausible typical "fowlerite" |
|
and rhodonite cation distributions |
|
_database_code_amcsd 0003774 |
|
9.8381 10.5361 12.2381 108.697 103.335 82.191 C-1 |
|
atom x y z Uiso U(1,1) U(2,2) U(3,3) U(2,3) U(1,3) U(1,2) |
|
Mn1 .00006 .03038 .14794 .0069 .0071 .0061 .0079 .0024 .0017 -.0009 |
|
Mn2 .00148 .12666 .44492 .0069 .0072 .0073 .0064 .0023 .0012 -.0013 |
|
Mn3 .01651 .20458 .72987 .0068 .0078 .0067 .0063 .0016 .0018 -.0015 |
|
Mn4 .06046 .26422 .0237 .0094 .0145 .0071 .0055 .0018 -.0021 -.0038 |
|
Mn5 .99571 .35515 .30519 .0121 .0093 .0145 .0170 .0091 .0047 -.0015 |
|
Si1 .2046 .4507 .9110 .0050 .0045 .0052 .0048 .0007 .0000 -.0022 |
|
Si2 .2123 .3669 .6539 .0048 .0046 .0057 .0041 .0016 -.0001 -.0018 |
|
Si3 .2174 .5803 .5298 .0053 .0053 .0060 .0037 .0008 -.0003 -.0010 |
|
Si4 .2148 .5068 .2613 .0051 .0051 .0061 .0038 .0016 -.0001 -.0012 |
|
Si5 .2052 .7010 .1249 .0054 .0052 .0061 .0048 .0019 .0001 -.0014 |
|
OA1 .1281 .0706 .0402 .0071 .0064 .0078 .0068 .0020 -.0004 -.0025 |
|
OA2 .1192 .1577 .3224 .0077 .0058 .0085 .0083 .0023 .0015 -.0001 |
|
OA3 .1138 .9221 .4362 .0074 .0035 .0089 .0092 .0027 -.0004 -.0019 |
|
OA4 .1183 .0131 .7316 .0080 .0049 .0111 .0099 .0057 .0020 .0005 |
|
OA5 .1300 .7907 .8534 .0078 .0057 .0078 .0088 .0024 .0000 .0001 |
|
OA6 .0984 .8328 .1308 .0077 .0066 .0051 .0107 .0020 .0022 .0013 |
|
OB1 .1286 .3225 .9019 .0089 .0093 .0076 .0096 .0023 -.0006 -.0047 |
|
OB2 .1247 .2369 .6113 .0079 .0094 .0068 .0077 .0016 .0004 -.0045 |
|
OB3 .1295 .7117 .5894 .0127 .0113 .0105 .0112 -.0008 .0001 .0027 |
|
OB4 .1262 .3813 .1838 .0106 .0119 .0089 .0084 -.0011 .0002 -.0045 |
|
OC1 .1695 .4699 .7776 .0072 .0101 .0067 .0036 .0000 .0006 -.0017 |
|
OC2 .1596 .4589 .5634 .0113 .0087 .0165 .0133 .0110 -.0004 -.0048 |
|
OC3 .1664 .5384 .3869 .0086 .0101 .0125 .0038 .0033 .0007 -.0023 |
|
OC4 .1585 .6422 .2201 .0078 .0101 .0089 .0065 .0044 .0026 -.0004 |
|
OC5 .1465 .5930 .9956 .0077 .0074 .0080 .0049 -.0010 .0001 -.0002 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Rhodonite |
|
Nelson W R, Griffen D T |
|
American Mineralogist 90 (2005) 969-983 |
|
Crystal chemistry of Zn-rich rhodonite ("fowlerite") |
|
Sample: 15-4024 |
|
Note: this is a plausible typical cation distribution for "fowlerite" |
|
_database_code_amcsd 0003775 |
|
9.7718 10.5084 12.2256 108.606 103.017 82.482 C-1 |
|
atom x y z occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
Mn1 -.00054 .02902 .14788 .921 .0075 .0094 .0076 .0062 .0023 .0026 -.0004 |
|
Fe1 -.00054 .02902 .14788 .041 .0075 .0094 .0076 .0062 .0023 .0026 -.0004 |
|
Ca1 -.00054 .02902 .14788 .038 .0075 .0094 .0076 .0062 .0023 .0026 -.0004 |
|
Mn2 .00095 .12814 .44549 .910 .0082 .0098 .0099 .0047 .0015 .0018 -.0018 |
|
Ca2 .00095 .12814 .44549 .050 .0082 .0098 .0099 .0047 .0015 .0018 -.0018 |
|
Fe2 .00095 .12814 .44549 .041 .0082 .0098 .0099 .0047 .0015 .0018 -.0018 |
|
Mn3 .01656 .20355 .73031 .910 .0077 .0099 .0086 .0052 .0018 .0030 -.0009 |
|
Ca3 .01656 .20355 .73031 .050 .0077 .0099 .0086 .0052 .0018 .0030 -.0009 |
|
Fe3 .01656 .20355 .73031 .041 .0077 .0099 .0086 .0052 .0018 .0030 -.0009 |
|
Mn4 .05979 .26466 .02610 .440 .0111 .0180 .0095 .0045 .0015 -.0006 -.0030 |
|
Zn4 .05979 .26466 .02610 .410 .0111 .0180 .0095 .0045 .0015 -.0006 -.0030 |
|
Mg4 .05979 .26466 .02610 .130 .0111 .0180 .0095 .0045 .0015 -.0006 -.0030 |
|
Fe4 .05979 .26466 .02610 .041 .0111 .0180 .0095 .0045 .0015 -.0006 -.0030 |
|
Ca5 .99392 .34520 .29879 .863 .0149 .0143 .0190 .0155 .0086 .0062 -.0011 |
|
Mn5 .99392 .34520 .29879 .094 .0149 .0143 .0190 .0155 .0086 .0062 -.0011 |
|
Fe5 .99392 .34520 .29879 .045 .0149 .0143 .0190 .0155 .0086 .0062 -.0011 |
|
Si1 .2046 .4504 .9110 .0069 .0077 .0085 .0040 .0008 .0012 -.0016 |
|
Si2 .2125 .3653 .6544 .0059 .0074 .0073 .0033 .0013 .0012 -.0017 |
|
Si3 .2154 .5785 .5317 .0065 .0074 .0090 .0026 .0011 .0007 -.0005 |
|
Si4 .2120 .5072 .2638 .0066 .0077 .0091 .0033 .0022 .0004 -.0012 |
|
Si5 .2044 .7004 .1249 .0063 .0075 .0080 .0029 .0006 .0014 -.0003 |
|
OA1 .1272 .0700 .0407 .0096 .0081 .0127 .0075 .0018 .0020 -.0012 |
|
OA2 .1183 .1583 .3208 .0082 .0061 .0108 .0086 .0041 .0021 .0005 |
|
OA3 .1153 .9203 .4351 .0093 .0085 .0120 .0075 .0025 .0016 -.0027 |
|
OA4 .1214 .0133 .7312 .0096 .0089 .0122 .0084 .0043 .0020 .0008 |
|
OA5 .1295 .7909 .8544 .0086 .0111 .0085 .0058 .0021 .0005 -.0010 |
|
OA6 .0990 .8328 .1309 .0093 .0096 .0078 .0095 .0015 .0015 -.0010 |
|
OB1 .1305 .3207 .9035 .0119 .0158 .0127 .0080 .0022 .0028 -.0050 |
|
OB2 .1251 .2342 .6118 .0093 .0138 .0105 .0048 .0027 .0015 -.0045 |
|
OB3 .1252 .7077 .5946 .0151 .0127 .0167 .0093 -.0024 -.0007 .0009 |
|
OB4 .1231 .3802 .1898 .0131 .0150 .0146 .0083 .0008 .0015 -.0039 |
|
OC1 .1687 .4684 .7777 .0094 .0136 .0126 .0013 -.0003 .0032 -.0014 |
|
OC2 .1621 .4538 .5616 .0144 .0132 .0227 .0129 .0131 .0005 -.0047 |
|
OC3 .1638 .5433 .3897 .0124 .0124 .0212 .0049 .0051 .0024 -.0012 |
|
OC4 .1567 .6396 .2189 .0089 .0104 .0127 .0063 .0055 .0026 -.0017 |
|
OC5 .1458 .5926 .9953 .0093 .0098 .0113 .0048 -.0007 .0019 -.0013 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Rhodonite |
|
Nelson W R, Griffen D T |
|
American Mineralogist 90 (2005) 969-983 |
|
Crystal chemistry of Zn-rich rhodonite ("fowlerite") |
|
Sample: 15-4025 |
|
Note: see samples 15-4029 and 15-4024 for plausible typical fowlerite |
|
and rhodonite cation distributions |
|
_database_code_amcsd 0003776 |
|
9.7999 10.5176 12.2365 108.587 103.185 82.320 C-1 |
|
atom x y z Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
Mn1 -.00034 .02954 .14809 .00812 .0081 .0092 .0084 .0041 .0031 .0014 |
|
Mn2 .00120 .12793 .44526 .00825 .0082 .0106 .0066 .0038 .0020 .0009 |
|
Mn3 .01663 .20381 .72996 .00756 .0088 .0087 .0063 .0031 .0035 .0010 |
|
Mn4 .06073 .26429 .02527 .01077 .0158 .0094 .0062 .0029 -.0003 -.0004 |
|
Mn5 .99431 .34853 .30080 .01544 .0118 .0215 .0194 .0131 .0076 .0017 |
|
Si1 .2047 .4510 .9108 .0063 .0055 .0088 .0052 .0025 .0024 .0004 |
|
Si2 .2124 .3659 .6541 .0057 .0051 .0079 .0052 .0037 .0019 .0008 |
|
Si3 .2163 .5792 .5310 .0064 .0065 .0091 .0036 .0021 .0016 .0013 |
|
Si4 .2129 .5074 .2633 .0068 .0065 .0104 .0044 .0039 .0014 .0010 |
|
Si5 .2045 .7004 .1249 .0064 .0064 .0084 .0053 .0036 .0021 .0020 |
|
OA1 .1274 .0700 .0407 .0072 .0051 .0100 .0076 .0038 .0030 .0016 |
|
OA2 .1186 .1582 .3211 .0089 .0090 .0082 .0112 .0036 .0042 -.0005 |
|
OA3 .1148 .9214 .4359 .0101 .0072 .014 .0107 .0058 .0013 -.0016 |
|
OA4 .1199 .0126 .7312 .0097 .0059 .013 .0116 .0049 .0040 .0011 |
|
OA5 .1299 .7900 .8532 .0085 .0066 .0117 .0064 .0017 .0005 -.0017 |
|
OA6 .0981 .8330 .1312 .0092 .0072 .0096 .0107 .0025 .0034 .0018 |
|
OB1 .1302 .3221 .9032 .0098 .0129 .0090 .0099 .0049 .0027 -.0026 |
|
OB2 .1248 .2351 .6116 .0088 .0088 .012 .0061 .0024 .0018 -.0020 |
|
OB3 .1278 .7094 .5935 .0166 .016 .015 .012 -.0013 .0024 .0088 |
|
OB4 .1240 .3808 .1884 .0133 .0122 .014 .0101 .0005 -.0004 -.0018 |
|
OC1 .1691 .4695 .7775 .0096 .0101 .015 .0036 .0026 .0038 .0025 |
|
OC2 .1610 .4549 .5621 .0139 .0095 .024 .0133 .0121 .0021 -.0023 |
|
OC3 .1647 .5423 .3893 .0113 .0116 .019 .0044 .0057 .0017 .0007 |
|
OC4 .1569 .6399 .2190 .0093 .0117 .0113 .0064 .0058 .0017 .0016 |
|
OC5 .1451 .5931 .9951 .0104 .0101 .015 .0057 .0007 .0039 .0009 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Rhodonite |
|
Nelson W R, Griffen D T |
|
American Mineralogist 90 (2005) 969-983 |
|
Crystal chemistry of Zn-rich rhodonite ("fowlerite") |
|
Sample: 15-4026 |
|
Note: see samples 15-4029 and 15-4024 for plausible typical fowlerite |
|
and rhodonite cation distributions |
|
_database_code_amcsd 0003777 |
|
9.7902 10.5184 12.2230 108.644 103.159 82.308 C-1 |
|
atom x y z Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
Mn1 -.0003 .0295 .1479 .0083 .0081 .0044 .0125 .0023 .0041 .0016 |
|
Mn2 .0012 .1277 .4450 .0084 .0072 .0067 .0108 .0018 .0030 .0010 |
|
Mn3 .0167 .2039 .7302 .0073 .0075 .0044 .0099 .0012 .0043 .0015 |
|
Mn4 .0603 .2644 .0252 .0102 .0139 .0054 .0094 .0015 -.0001 -.0005 |
|
Mn5 .9944 .3483 .3008 .0149 .0107 .0157 .0243 .0118 .0085 .0019 |
|
Si1 .2049 .4507 .9112 .0070 .0053 .0040 .0115 .0012 .0040 .0019 |
|
Si2 .2125 .3662 .6544 .0066 .0053 .0031 .0112 .0008 .0036 .0002 |
|
Si3 .2158 .5791 .5306 .0070 .0059 .0052 .0092 .0014 .0024 .0016 |
|
Si4 .2130 .5072 .2630 .0068 .0061 .0061 .0076 .0017 .0015 .0006 |
|
Si5 .2045 .7004 .1247 .0067 .0056 .0036 .0106 .0016 .0040 .0029 |
|
OA1 .1272 .0694 .0400 .0095 .007 .006 .014 .002 .004 .0023 |
|
OA2 .1189 .1584 .3211 .0079 .010 .006 .008 -.0003 .0057 -.0015 |
|
OA3 .1144 .9215 .4358 .0078 .006 .005 .009 -.0026 .0009 .0014 |
|
OA4 .1196 .0134 .7312 .0087 .003 .003 .019 .003 .004 .0040 |
|
OA5 .1298 .7912 .8539 .0104 .008 .006 .014 .000 .004 .0012 |
|
OA6 .0992 .8326 .1316 .0111 .010 .004 .019 .001 .006 .0017 |
|
OB1 .1287 .3214 .9025 .0116 .013 .007 .016 .002 .005 -.002 |
|
OB2 .1241 .2347 .6110 .0088 .008 .010 .010 .005 .0019 .0007 |
|
OB3 .1269 .7088 .5925 .0151 .013 .011 .014 -.002 .000 .005 |
|
OB4 .1237 .3798 .1877 .0130 .011 .009 .017 .001 .001 -.002 |
|
OC1 .1693 .4681 .7781 .0094 .011 .007 .008 -.0022 .0050 .0020 |
|
OC2 .1610 .4546 .5627 .0143 .008 .021 .020 .015 -.001 -.003 |
|
OC3 .1652 .5417 .3890 .0113 .010 .016 .010 .006 .004 .001 |
|
OC4 .1569 .6411 .2195 .0095 .010 .009 .011 .004 .0044 .0040 |
|
OC5 .1454 .5930 .9952 .0098 .008 .006 .011 -.0026 .0018 .0001 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Rhodonite |
|
Nelson W R, Griffen D T |
|
American Mineralogist 90 (2005) 969-983 |
|
Crystal chemistry of Zn-rich rhodonite ("fowlerite") |
|
Sample: 15-4030 |
|
Note: see samples 15-4029 and 15-4024 for plausible typical fowlerite |
|
and rhodonite cation distributions |
|
_database_code_amcsd 0003778 |
|
9.8451 10.5389 12.2414 108.692 103.299 82.184 C-1 |
|
atom x y z Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
Mn1 .00023 .03036 .14794 .0076 .0097 .0069 .0078 .0035 .0036 .0001 |
|
Mn2 .00154 .12666 .44508 .0079 .0094 .0089 .0067 .0031 .0030 -.0002 |
|
Mn3 .01613 .20466 .72987 .0078 .0098 .0078 .0071 .0029 .0038 .0000 |
|
Mn4 .05931 .26420 .02365 .0107 .0177 .0084 .0057 .0028 .0004 -.0014 |
|
Mn5 .99566 .35591 .30576 .0131 .0124 .0154 .0166 .0094 .0066 -.0004 |
|
Si1 .2047 .4507 .9111 .0068 .0075 .0085 .0051 .0022 .0025 -.0005 |
|
Si2 .2121 .3672 .6539 .0061 .0074 .0064 .0062 .0029 .0031 -.0003 |
|
Si3 .2174 .5802 .5297 .0062 .0072 .0079 .0042 .0026 .0020 .0001 |
|
Si4 .2150 .5068 .2613 .0062 .0071 .0081 .0046 .0029 .0019 -.0005 |
|
Si5 .2056 .7013 .1251 .0066 .0080 .0076 .0054 .0028 .0027 .0003 |
|
OA1 .1282 .0706 .0406 .0093 .0086 .0119 .0087 .0045 .0012 -.0020 |
|
OA2 .1201 .1576 .3225 .0087 .0074 .0105 .0084 .0031 .0017 -.0002 |
|
OA3 .1143 .9223 .4362 .0084 .0066 .0094 .0111 .0051 .0027 -.0007 |
|
OA4 .1181 .0132 .7318 .0095 .0077 .0124 .0114 .0076 .0025 -.0002 |
|
OA5 .1300 .7906 .8536 .0091 .0091 .0094 .0093 .0035 .0038 .0023 |
|
OA6 .0992 .8326 .1311 .0092 .0084 .0070 .0133 .0042 .0032 .0008 |
|
OB1 .1285 .3226 .9022 .0108 .0122 .0114 .0107 .0049 .0026 -.0032 |
|
OB2 .1243 .2365 .6107 .0111 .0150 .0102 .0088 .0021 .0028 -.0047 |
|
OB3 .1303 .7118 .5893 .0132 .0128 .0112 .0124 -.0003 .0041 .0030 |
|
OB4 .1283 .3810 .1839 .0127 .0152 .0130 .0085 .0013 .0014 -.0032 |
|
OC1 .1694 .4695 .7777 .0091 .0120 .0120 .0047 .0030 .0045 .0003 |
|
OC2 .1590 .4591 .5634 .0115 .0101 .0181 .0120 .0116 .0030 -.0007 |
|
OC3 .1662 .5382 .3869 .0098 .0102 .0155 .0059 .0046 .0038 -.0011 |
|
OC4 .1594 .6415 .2200 .0094 .0096 .0118 .0102 .0075 .0052 .0033 |
|
OC5 .1464 .5933 .9954 .0088 .0105 .0094 .0063 .0017 .0034 .0013 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Rhodonite |
|
Nelson W R, Griffen D T |
|
American Mineralogist 90 (2005) 969-983 |
|
Crystal chemistry of Zn-rich rhodonite ("fowlerite") |
|
Sample: 15-4031 |
|
Note: see samples 15-4029 and 15-4024 for plausible typical fowlerite |
|
and rhodonite cation distributions |
|
_database_code_amcsd 0003779 |
|
9.8121 10.5187 12.2180 108.651 103.217 82.308 C-1 |
|
atom x y z Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
Mn1 .00026 .03004 .14802 .0063 .0077 .0062 .0053 .0017 .0033 .0020 |
|
Mn2 .00127 .12716 .44510 .0064 .0079 .0073 .0040 .0015 .0024 .0016 |
|
Mn3 .01627 .20448 .73016 .0064 .0085 .0061 .0045 .0009 .0035 .0018 |
|
Mn4 .05944 .26430 .02431 .0096 .0161 .0069 .0040 .0010 -.0003 .0001 |
|
Mn5 .99553 .35280 .30368 .0137 .0122 .0170 .0164 .0091 .0070 .0017 |
|
Si1 .2044 .4504 .9113 .0050 .0054 .0056 .0033 .0002 .0018 .0014 |
|
Si2 .2121 .3664 .6539 .0045 .0052 .0056 .0029 .0014 .0020 .0011 |
|
Si3 .2166 .5795 .5302 .0049 .0057 .0057 .0028 .0009 .0021 .0026 |
|
Si4 .2143 .5067 .2618 .0051 .0057 .0074 .0020 .0017 .0016 .0018 |
|
Si5 .2055 .7009 .1251 .0053 .0059 .0068 .0031 .0013 .0021 .0019 |
|
OA1 .1275 .0708 .0406 .0077 .0065 .0077 .0074 .0010 .0017 .0026 |
|
OA2 .1191 .1575 .3219 .0070 .0037 .0091 .0078 .0019 .0028 .0021 |
|
OA3 .1147 .9215 .4363 .0092 .0082 .0098 .0079 .0005 .0018 -.0002 |
|
OA4 .1189 .0130 .7318 .0079 .0070 .0091 .0081 .0036 .0025 .0021 |
|
OA5 .1296 .7900 .8537 .0076 .0082 .0079 .0056 .0006 .0028 .0020 |
|
OA6 .0994 .8332 .1313 .0082 .0103 .0059 .0083 .0012 .0034 .0005 |
|
OB1 .1283 .3219 .9029 .0103 .0138 .0074 .0103 .0013 .0052 -.0012 |
|
OB2 .1250 .2359 .6114 .0083 .0112 .0076 .0060 .0009 .0018 -.0030 |
|
OB3 .1279 .7104 .5905 .0138 .0132 .0116 .0099 -.0025 .0018 .0074 |
|
OB4 .1264 .3807 .1852 .0111 .0132 .0100 .0068 -.0010 .0001 -.0021 |
|
OC1 .1692 .4695 .7779 .0083 .0114 .0087 .0035 .0002 .0035 .0036 |
|
OC2 .1598 .4575 .5631 .0114 .0102 .0183 .0100 .0109 .0008 -.0008 |
|
OC3 .1652 .5391 .3875 .0103 .0107 .0177 .0034 .0040 .0030 .0014 |
|
OC4 .1586 .6413 .2200 .0087 .0111 .0107 .0060 .0044 .0046 .0032 |
|
OC5 .1464 .5930 .9955 .0088 .0099 .0087 .0050 -.0014 .0027 .0032 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Rhodonite |
|
Nelson W R, Griffen D T |
|
American Mineralogist 90 (2005) 969-983 |
|
Crystal chemistry of Zn-rich rhodonite ("fowlerite") |
|
Sample: 15-4033 |
|
Note: see samples 15-4029 and 15-4024 for plausible typical fowlerite |
|
and rhodonite cation distributions |
|
_database_code_amcsd 0003780 |
|
9.7834 10.5023 12.2338 108.682 103.273 82.213 C-1 |
|
atom x y z Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
Mn1 -.00085 .02972 .14763 .0076 .0086 .0067 .0086 .0038 .0030 .0009 |
|
Mn2 .00127 .12683 .44458 .0077 .0082 .0080 .0073 .0029 .0023 .0004 |
|
Mn3 .01677 .20350 .72977 .0077 .0089 .0069 .0083 .0026 .0037 .0008 |
|
Mn4 .06199 .26365 .02470 .0114 .0175 .0083 .0076 .0032 -.0012 -.0019 |
|
Mn5 .99470 .34929 .30121 .0161 .0122 .0199 .0231 .0139 .0076 .0012 |
|
Si1 .2043 .4508 .9105 .0060 .0055 .0065 .0060 .0019 .0014 .0000 |
|
Si2 .2121 .3661 .6542 .0056 .0053 .0062 .0065 .0033 .0018 .0006 |
|
Si3 .2160 .5790 .5303 .0063 .0055 .0071 .0060 .0019 .0014 .0009 |
|
Si4 .2129 .5072 .2626 .0065 .0066 .0072 .0064 .0033 .0013 .0004 |
|
Si5 .2038 .7008 .1247 .0062 .0057 .0069 .0067 .0033 .0019 .0012 |
|
OA1 .1267 .0695 .0403 .0077 .0065 .0073 .0087 .0016 .0019 -.0002 |
|
OA2 .1181 .1576 .3209 .0082 .0064 .0088 .0093 .0029 .0022 .0012 |
|
OA3 .1144 .9223 .4358 .0091 .0059 .0103 .0115 .0034 .0019 -.0008 |
|
OA4 .1191 .0126 .7308 .0093 .0061 .0091 .0139 .0063 .0024 .0026 |
|
OA5 .1299 .7916 .8538 .0093 .0091 .0075 .0101 .0018 .0011 -.0003 |
|
OA6 .0977 .8334 .1310 .0098 .0103 .0081 .0126 .0049 .0038 .0008 |
|
OB1 .1299 .3211 .9020 .0114 .0149 .0084 .0109 .0022 .0020 -.0039 |
|
OB2 .1246 .2347 .6109 .0087 .0099 .0084 .0088 .0026 .0028 -.0023 |
|
OB3 .1275 .7096 .5918 .0171 .0135 .0137 .0158 -.0028 .0010 .0062 |
|
OB4 .1245 .3803 .1863 .0127 .0139 .0108 .0106 .0001 -.0001 -.0034 |
|
OC1 .1681 .4694 .7774 .0086 .0123 .0088 .0047 .0017 .0029 .0009 |
|
OC2 .1601 .4553 .5622 .0145 .0100 .0215 .0187 .0160 .0002 -.0035 |
|
OC3 .1641 .5406 .3881 .0112 .0106 .0193 .0061 .0077 .0013 .0004 |
|
OC4 .1564 .6415 .2201 .0088 .0098 .0109 .0087 .0069 .0037 .0018 |
|
OC5 .1449 .5929 .9954 .0098 .0084 .0098 .0082 -.0004 .0005 -.0005 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Rhodonite |
|
Nelson W R, Griffen D T |
|
American Mineralogist 90 (2005) 969-983 |
|
Crystal chemistry of Zn-rich rhodonite ("fowlerite") |
|
Sample: 15-4034 |
|
Note: see samples 15-4029 and 15-4024 for plausible typical fowlerite |
|
and rhodonite cation distributions |
|
_database_code_amcsd 0003781 |
|
9.7648 10.4912 12.2228 108.671 103.177 82.284 C-1 |
|
atom x y z Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
Mn1 -.00101 .02939 .14751 .0077 .0082 .0073 .0083 .0018 .0036 -.0007 |
|
Mn2 .00116 .12727 .44477 .0083 .0091 .0091 .0069 .0014 .0029 -.0012 |
|
Mn3 .01674 .20328 .72983 .0073 .0084 .0068 .0070 .0009 .0040 -.0008 |
|
Mn4 .06192 .26382 .02522 .0117 .0183 .0089 .0067 .0017 -.0004 -.0029 |
|
Mn5 .99427 .34716 .29972 .0161 .0128 .0198 .0216 .0114 .0079 -.0005 |
|
Si1 .2045 .4506 .9105 .0066 .0062 .0066 .0063 .0000 .0022 -.0016 |
|
Si2 .2121 .3656 .6542 .0059 .0063 .0067 .0052 .0014 .0023 -.0016 |
|
Si3 .2154 .5786 .5308 .0068 .0069 .0081 .0051 .0010 .0024 -.0001 |
|
Si4 .2122 .5072 .2632 .0068 .0064 .0081 .0060 .0021 .0012 -.0012 |
|
Si5 .2039 .7007 .1248 .0065 .0071 .0071 .0051 .0006 .0027 -.0008 |
|
OA1 .1271 .0697 .0406 .0088 .0092 .0084 .0077 .0015 .0011 -.0004 |
|
OA2 .1187 .1581 .3208 .0079 .0066 .0091 .0080 .0024 .0019 .0002 |
|
OA3 .1148 .9213 .4360 .0088 .0055 .0111 .0096 .0022 .0015 -.0018 |
|
OA4 .1200 .0129 .7311 .0093 .0063 .0092 .0119 .0025 .0021 .0005 |
|
OA5 .1301 .7913 .8537 .0089 .0097 .0094 .0079 .0020 .0020 -.0027 |
|
OA6 .0980 .8329 .1309 .0097 .0101 .0073 .0117 .0022 .0035 .0001 |
|
OB1 .1299 .3205 .9026 .0123 .0151 .0123 .0104 .0013 .0051 -.0051 |
|
OB2 .1249 .2342 .6111 .0095 .0124 .0085 .0074 -.0004 .0027 -.0052 |
|
OB3 .1260 .7088 .5927 .0171 .0138 .0150 .0149 -.0034 .0031 .0059 |
|
OB4 .1232 .3801 .1876 .0138 .0152 .0135 .0095 -.0012 .0016 -.0030 |
|
OC1 .1681 .4693 .7775 .0092 .0138 .0093 .0047 .0002 .0035 -.0032 |
|
OC2 .1606 .4543 .5619 .0148 .0113 .0219 .0169 .0141 -.0005 -.0053 |
|
OC3 .1638 .5422 .3891 .0119 .0101 .0203 .0079 .0064 .0041 -.0005 |
|
OC4 .1561 .6414 .2199 .0097 .0120 .0118 .0077 .0056 .0030 -.0001 |
|
OC5 .1453 .5923 .9951 .0093 .0088 .0091 .0070 -.0015 .0014 -.0003 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Rhodonite |
|
Nelson W R, Griffen D T |
|
American Mineralogist 90 (2005) 969-983 |
|
Crystal chemistry of Zn-rich rhodonite ("fowlerite") |
|
Sample: 15-4006 |
|
Note: see samples 15-4029 and 15-4024 for plausible typical fowlerite |
|
and rhodonite cation distributions |
|
_database_code_amcsd 0003782 |
|
9.8456 10.4992 12.2005 108.726 103.724 82.113 C-1 |
|
atom x y z Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
Mn1 -.00151 .03115 .14654 .0074 .0061 .0046 .0077 .0008 .0016 -.0012 |
|
Mn2 .00065 .12635 .44397 .0077 .0065 .0063 .0066 .0010 .0010 -.0016 |
|
Mn3 .01668 .20343 .72901 .0075 .0063 .0052 .0066 .0002 .0018 -.0014 |
|
Zn4 .06712 .26312 .02153 .0111 .0158 .0058 .0056 .0005 -.0020 -.0041 |
|
Ca5 .99344 .35605 .30399 .0127 .0084 .0117 .0173 .0071 .0047 -.0014 |
|
Si1 .20479 .44854 .91124 .0058 .0038 .0044 .0045 -.0008 .0000 -.0021 |
|
Si2 .21323 .36551 .65358 .0053 .0037 .0033 .0045 .0004 .0004 -.0021 |
|
Si3 .21695 .57884 .52862 .0058 .0040 .0046 .0041 .0000 .0001 -.0012 |
|
Si4 .21289 .50576 .25926 .0062 .0041 .0055 .0051 .0014 .0001 -.0015 |
|
Si5 .20225 .70063 .12368 .0060 .0045 .0038 .0055 .0002 .0008 -.0009 |
|
OA1 .1271 .0731 .0394 .0081 .0040 .0069 .0093 .0020 -.0004 -.0019 |
|
OA2 .1184 .1581 .3219 .0077 .0030 .0066 .0088 .0016 .0004 -.0017 |
|
OA3 .1138 .9230 .4368 .0083 .0042 .0074 .0087 .0017 -.0005 -.0026 |
|
OA4 .1201 .0134 .7327 .0081 .0049 .0076 .0108 .0031 .0016 -.0005 |
|
OA5 .1330 .7907 .8537 .0086 .0048 .0072 .0098 .0008 .0010 -.0023 |
|
OA6 .0956 .8321 .1278 .0099 .0076 .0047 .0123 .0023 .0017 .0013 |
|
OB1 .1298 .3183 .9017 .0101 .0088 .0076 .0094 .0013 .0007 -.0053 |
|
OB2 .1253 .2346 .6102 .0090 .0093 .0081 .0078 .0011 .0006 -.0052 |
|
OB3 .1302 .7111 .5880 .0130 .0102 .0091 .0119 -.0024 .0014 .0030 |
|
OB4 .1240 .3799 .1799 .0111 .0096 .0086 .0092 -.0006 .0005 -.0039 |
|
OC1 .1702 .4679 .7777 .0076 .0087 .0068 .0049 .0002 .0017 -.0003 |
|
OC2 .1599 .4576 .5632 .0118 .0073 .0139 .0106 .0079 .0002 -.0034 |
|
OC3 .1649 .5351 .3853 .0098 .0083 .0143 .0044 .0024 .0000 -.0031 |
|
OC4 .1564 .6431 .2206 .0085 .0080 .0080 .0073 .0041 .0021 -.0002 |
|
OC5 .1452 .5899 .9951 .0091 .0066 .0083 .0076 -.0018 .0010 -.0010 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Rhodonite |
|
Nelson W R, Griffen D T |
|
American Mineralogist 90 (2005) 969-983 |
|
Crystal chemistry of Zn-rich rhodonite ("fowlerite") |
|
Sample: 15-4014 |
|
Note: see samples 15-4029 and 15-4024 for plausible typical fowlerite |
|
and rhodonite cation distributions |
|
_database_code_amcsd 0003783 |
|
9.8768 10.5222 12.2180 108.748 103.781 82.037 C-1 |
|
atom x y z Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
Mn1 -.00146 .03131 .14668 .0079 .0070 .0070 .0097 .0023 .0028 .0009 |
|
Mn2 .00075 .12599 .44403 .0080 .0071 .0078 .0091 .0026 .0023 .0007 |
|
Mn3 .01672 .20418 .72898 .0081 .0078 .0075 .0087 .0017 .0028 .0006 |
|
Zn4 .06686 .26320 .02122 .0114 .0163 .0085 .0077 .0021 -.0008 -.0019 |
|
Ca5 .99362 .35906 .30631 .0104 .0087 .0098 .0147 .0048 .0050 .0003 |
|
Si1 .20495 .44901 .91116 .0065 .0052 .0068 .0066 .0008 .0017 .0001 |
|
Si2 .21321 .36630 .65340 .0058 .0046 .0059 .0069 .0021 .0013 .0005 |
|
Si3 .21794 .57993 .52844 .0061 .0051 .0068 .0061 .0019 .0014 .0008 |
|
Si4 .21385 .50566 .25871 .0066 .0050 .0077 .0072 .0027 .0015 .0004 |
|
Si5 .20233 .70059 .12362 .0068 .0061 .0063 .0077 .0020 .0023 .0014 |
|
OA1 .1274 .0730 .0397 .0091 .0047 .0112 .0115 .0043 .0012 .0012 |
|
OA2 .1188 .1577 .3225 .0088 .0047 .0106 .0108 .0032 .0018 .0009 |
|
OA3 .1134 .9230 .4366 .0085 .0054 .0096 .0103 .0025 .0015 -.0004 |
|
OA4 .1196 .0136 .7328 .0089 .0064 .0085 .0122 .0041 .0024 .0012 |
|
OA5 .1331 .7902 .8530 .0093 .0069 .0085 .0123 .0028 .0028 .0005 |
|
OA6 .0954 .8314 .1276 .0097 .0082 .0069 .0139 .0034 .0033 .0026 |
|
OB1 .1298 .3196 .9014 .0105 .0112 .0094 .0113 .0031 .0020 -.0026 |
|
OB2 .1260 .2359 .6100 .0098 .0106 .0090 .0094 .0019 .0016 -.0028 |
|
OB3 .1316 .7125 .5867 .0110 .0092 .0101 .0123 .0018 .0046 .0041 |
|
OB4 .1256 .3803 .1794 .0108 .0113 .0105 .0090 -.0005 .0027 -.0030 |
|
OC1 .1706 .4680 .7776 .0087 .0095 .0086 .0072 .0013 .0030 .0016 |
|
OC2 .1595 .4597 .5639 .0098 .0078 .0113 .0122 .0071 .0016 .0002 |
|
OC3 .1663 .5346 .3850 .0101 .0087 .0144 .0068 .0025 .0019 -.0007 |
|
OC4 .1566 .6426 .2202 .0091 .0089 .0104 .0094 .0057 .0033 .0031 |
|
OC5 .1455 .5899 .9951 .0099 .0078 .0107 .0083 -.0007 .0016 .0006 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Rhodonite |
|
Nelson W R, Griffen D T |
|
American Mineralogist 90 (2005) 969-983 |
|
Crystal chemistry of Zn-rich rhodonite ("fowlerite") |
|
Sample: 15-4020 |
|
Note: see samples 15-4029 and 15-4024 for plausible typical fowlerite |
|
and rhodonite cation distributions |
|
_database_code_amcsd 0003784 |
|
9.8393 10.4941 12.1977 108.751 103.751 82.091 C-1 |
|
atom x y z Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
Mn1 -.00166 .03116 .14652 .0068 .0084 .0046 .0074 .0018 .0024 .0003 |
|
Mn2 .00066 .12629 .44394 .0069 .0085 .0058 .0061 .0018 .0017 .0001 |
|
Mn3 .01659 .20350 .72902 .0068 .0088 .0051 .0066 .0014 .0027 .0002 |
|
Zn4 .06736 .26305 .02148 .0100 .0178 .0056 .0054 .0018 -.0010 -.0024 |
|
Ca5 .99327 .35632 .30409 .0117 .0109 .0117 .0163 .0077 .0056 -.0001 |
|
Si1 .20478 .44852 .91125 .0053 .0062 .0042 .0051 .0009 .0008 -.0006 |
|
Si2 .21313 .36537 .65353 .0047 .0060 .0039 .0049 .0016 .0017 -.0004 |
|
Si3 .21691 .57916 .52866 .0053 .0061 .0049 .0049 .0017 .0014 .0003 |
|
Si4 .21294 .50565 .25923 .0058 .0064 .0054 .0058 .0024 .0014 .0005 |
|
Si5 .20221 .70052 .1235 .0055 .0073 .0039 .0050 .0008 .0020 .0009 |
|
OA1 .1272 .0731 .0394 .0076 .0066 .0081 .0079 .0031 .0003 .0003 |
|
OA2 .1183 .1581 .3220 .0074 .0057 .0075 .0089 .0023 .0012 -.0011 |
|
OA3 .1138 .9229 .4364 .0077 .0071 .0072 .0077 .0010 .0003 -.0023 |
|
OA4 .1204 .0136 .7331 .0081 .0073 .0074 .0106 .0039 .0034 .0018 |
|
OA5 .1331 .7902 .8530 .0087 .0077 .0067 .0110 .0022 .0023 .0010 |
|
OA6 .0953 .8320 .1277 .0080 .0086 .0041 .0102 .0019 .0008 .0008 |
|
OB1 .1300 .3188 .9018 .0095 .0122 .0077 .0095 .0026 .0021 -.0044 |
|
OB2 .1262 .2344 .6102 .0081 .0111 .0057 .0071 .0015 .0011 -.0022 |
|
OB3 .1301 .7118 .5880 .0119 .0136 .0088 .0096 -.0009 .0031 .0043 |
|
OB4 .1238 .3798 .1799 .0106 .0127 .0081 .0100 .0010 .0015 -.0033 |
|
OC1 .1700 .4677 .7777 .0078 .0122 .0073 .0042 .0014 .0031 .0005 |
|
OC2 .1599 .4577 .5634 .0103 .0080 .0143 .0121 .0097 .0006 -.0010 |
|
OC3 .1647 .5352 .3852 .0094 .0111 .0140 .0040 .0045 .0012 -.0006 |
|
OC4 .1561 .6429 .2203 .0080 .0094 .0080 .0086 .0054 .0036 .0035 |
|
OC5 .1454 .5896 .9951 .0082 .0092 .0072 .0060 .0000 .0016 .0015 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Rhodonite |
|
Nelson W R, Griffen D T |
|
American Mineralogist 90 (2005) 969-983 |
|
Crystal chemistry of Zn-rich rhodonite ("fowlerite") |
|
Sample: 15-4027 |
|
Note: see samples 15-4029 and 15-4024 for plausible typical fowlerite |
|
and rhodonite cation distributions |
|
_database_code_amcsd 0003785 |
|
9.8337 10.4987 12.1966 108.699 103.597 82.221 C-1 |
|
atom x y z Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
Mn1 -.00129 .03089 .14665 .0073 .0088 .0075 .0066 .0022 .0039 -.0004 |
|
Mn2 .00065 .12699 .44432 .0076 .0094 .0105 .0064 .0029 .0034 -.0006 |
|
Mn3 .01646 .20326 .72930 .0072 .0099 .0092 .0062 .0019 .0042 .0002 |
|
Zn4 .06612 .26335 .02203 .0111 .0185 .0079 .0045 .0018 .0004 -.0034 |
|
Ca5 .99333 .35410 .30248 .0139 .0115 .0175 .0192 .0101 .0076 -.0007 |
|
Si1 .20482 .44858 .91140 .0059 .0079 .0079 .0045 .0007 .0032 -.0007 |
|
Si2 .21307 .36507 .65394 .0053 .0084 .0078 .0049 .0020 .0035 .0006 |
|
Si3 .21659 .57849 .52910 .0059 .0088 .0097 .0049 .0027 .0027 .0005 |
|
Si4 .21250 .50579 .25977 .0061 .0080 .0090 .0053 .0035 .0028 .0004 |
|
Si5 .20261 .70071 .12396 .0060 .0101 .0081 .0059 .0024 .0042 .0009 |
|
OA1 .1273 .0733 .0393 .0083 .0081 .0127 .0078 .0019 .0002 -.0026 |
|
OA2 .1185 .1585 .3216 .0082 .0068 .0129 .0111 .0037 .0025 -.0015 |
|
OA3 .1143 .9226 .4365 .0084 .0107 .0116 .0080 .0026 .0026 -.0021 |
|
OA4 .1206 .0134 .7329 .0089 .0103 .0120 .0126 .0074 .0047 .0032 |
|
OA5 .1325 .7899 .8537 .0083 .0117 .0100 .0100 .0046 .0064 .0022 |
|
OA6 .0959 .8322 .1281 .0088 .0131 .0102 .0111 .0048 .0049 .0012 |
|
OB1 .1298 .3187 .9021 .0098 .0136 .0141 .0094 .0047 .0027 -.0007 |
|
OB2 .1255 .2343 .6110 .0093 .0123 .0103 .0095 .0026 .0024 -.0042 |
|
OB3 .1291 .7100 .5894 .0148 .0121 .0151 .0125 -.0017 .0014 .0041 |
|
OB4 .1238 .3796 .1810 .0110 .0119 .0115 .0120 .0011 .0040 -.0014 |
|
OC1 .1701 .4674 .7777 .0085 .0136 .0099 .0062 .0009 .0053 -.0005 |
|
OC2 .1602 .4562 .5626 .0123 .0131 .0220 .0136 .0143 .0031 -.0007 |
|
OC3 .1642 .5362 .3859 .0105 .0119 .0215 .0035 .0053 .0034 .0005 |
|
OC4 .1562 .6427 .2205 .0085 .0071 .0124 .0093 .0082 .0037 .0013 |
|
OC5 .1452 .5903 .9953 .0092 .0072 .0127 .0044 -.0020 .0022 .0002 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Rhodonite |
|
Nelson W R, Griffen D T |
|
American Mineralogist 90 (2005) 969-983 |
|
Crystal chemistry of Zn-rich rhodonite ("fowlerite") |
|
Sample: 15-4028 |
|
Note: see samples 15-4029 and 15-4024 for plausible typical fowlerite |
|
and rhodonite cation distributions |
|
_database_code_amcsd 0003786 |
|
9.8640 10.5237 12.2180 108.727 103.705 82.082 C-1 |
|
atom x y z Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
Mn1 -.00128 .03111 .14683 .0066 .0056 .0067 .0080 .0024 .0026 .0000 |
|
Mn2 .00093 .12617 .44421 .0066 .0056 .0079 .0069 .0024 .0022 -.0001 |
|
Mn3 .01673 .20418 .72918 .0066 .0061 .0073 .0068 .0016 .0027 -.0003 |
|
Zn4 .06598 .26339 .02164 .0102 .0152 .0083 .0061 .0020 -.0008 -.0028 |
|
Ca5 .99395 .35807 .30592 .0102 .0078 .0114 .0145 .0062 .0053 -.0005 |
|
Si1 .20500 .44935 .91108 .0051 .0037 .0067 .0044 .0010 .0010 -.0008 |
|
Si2 .21304 .36632 .65348 .0047 .0036 .0062 .0049 .0022 .0017 -.0003 |
|
Si3 .21770 .57982 .52867 .0047 .0031 .0069 .0044 .0017 .0014 -.0001 |
|
Si4 .21395 .50607 .2594 .0054 .0036 .0078 .0054 .0026 .0015 .0000 |
|
Si5 .20285 .70063 .12388 .0054 .0043 .0063 .0060 .0019 .0022 .0008 |
|
OA1 .1270 .0722 .0397 .0075 .0037 .0101 .0085 .0024 .0016 .0001 |
|
OA2 .1188 .1577 .3225 .0074 .0020 .0108 .0101 .0038 .0022 .0000 |
|
OA3 .1135 .9230 .4365 .0076 .0045 .0097 .0084 .0027 .0007 -.0011 |
|
OA4 .1194 .0131 .7325 .0078 .0039 .0098 .0112 .0044 .0027 .0003 |
|
OA5 .1329 .7901 .8529 .0078 .0050 .0089 .0090 .0016 .0022 -.0006 |
|
OA6 .0957 .8320 .1284 .0088 .0082 .0070 .0122 .0038 .0040 .0015 |
|
OB1 .1298 .3200 .9015 .0092 .0097 .0093 .0094 .0024 .0026 -.0036 |
|
OB2 .1254 .2360 .6102 .0080 .0081 .0082 .0078 .0020 .0008 -.0039 |
|
OB3 .1310 .7122 .5872 .0104 .0086 .0096 .0117 .0017 .0032 .0023 |
|
OB4 .1258 .3807 .1804 .0102 .0082 .0118 .0094 .0007 .0017 -.0038 |
|
OC1 .1706 .4686 .7777 .0075 .0078 .0091 .0061 .0018 .0037 .0011 |
|
OC2 .1597 .4592 .5635 .0093 .0076 .0136 .0100 .0074 .0020 -.0019 |
|
OC3 .1662 .5354 .3855 .0092 .0085 .0153 .0046 .0031 .0019 -.0020 |
|
OC4 .1571 .6423 .2203 .0078 .0076 .0102 .0081 .0058 .0030 .0013 |
|
OC5 .1457 .5907 .99514 .0081 .0064 .0097 .0057 -.0009 .0014 .0001 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Rhodonite |
|
Nelson W R, Griffen D T |
|
American Mineralogist 90 (2005) 969-983 |
|
Crystal chemistry of Zn-rich rhodonite ("fowlerite") |
|
Sample: 15-4029 |
|
Note: this is a plausible typical cation distribution for rhodonite |
|
_database_code_amcsd 0003787 |
|
9.8793 10.5298 12.2257 108.744 103.752 82.030 C-1 |
|
atom x y z occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
Mn1 -.00119 .03115 .14686 .871 .0073 .0067 .0060 .0091 .0025 .0012 -.0003 |
|
Fe1 -.00119 .03115 .14686 .080 .0073 .0067 .0060 .0091 .0025 .0012 -.0003 |
|
Ca1 -.00119 .03115 .14686 .050 .0073 .0067 .0060 .0091 .0025 .0012 -.0003 |
|
Mn2 .00090 .12570 .44400 .871 .0071 .0062 .0068 .0080 .0026 .0004 -.0002 |
|
Fe2 .00090 .12570 .44400 .080 .0071 .0062 .0068 .0080 .0026 .0004 -.0002 |
|
Ca2 .00090 .12570 .44400 .050 .0071 .0062 .0068 .0080 .0026 .0004 -.0002 |
|
Mn3 .01673 .20471 .72902 .871 .0076 .0074 .0068 .0080 .0017 .0012 -.0002 |
|
Ca3 .01673 .20471 .72902 .100 .0076 .0074 .0068 .0080 .0017 .0012 -.0002 |
|
Fe3 .01673 .20471 .72902 .080 .0076 .0074 .0068 .0080 .0017 .0012 -.0002 |
|
Mn4 .06622 .26336 .02146 .822 .0111 .0163 .0075 .0072 .0022 -.0029 -.0031 |
|
Mg4 .06622 .26336 .02146 .100 .0111 .0163 .0075 .0072 .0022 -.0029 -.0031 |
|
Fe4 .06622 .26336 .02146 .080 .0111 .0163 .0075 .0072 .0022 -.0029 -.0031 |
|
Zn4 .06622 .26336 .02146 .005 .0111 .0163 .0075 .0072 .0022 -.0029 -.0031 |
|
Mn5 .99400 .35950 .30700 .857 .0094 .0083 .0080 .0130 .0039 .0033 -.0006 |
|
Ca5 .99400 .35950 .30700 .100 .0094 .0083 .0080 .0130 .0039 .0033 -.0006 |
|
Fe5 .99400 .35950 .30700 .080 .0094 .0083 .0080 .0130 .0039 .0033 -.0006 |
|
Si1 .20494 .44933 .91094 .0057 .0045 .0061 .0056 .0015 -.0007 -.0008 |
|
Si2 .21318 .36657 .65330 .0052 .0045 .0052 .0058 .0020 -.000 -.0007 |
|
Si3 .21805 .58031 .52835 .0053 .0043 .0059 .0054 .0021 -.0003 -.0002 |
|
Si4 .21443 .50584 .25906 .0058 .0046 .0067 .0064 .0028 .0000 -.0006 |
|
Si5 .20289 .70043 .12364 .0062 .0054 .0055 .0070 .0020 .0002 .0004 |
|
OA1 .1277 .0722 .0399 .0083 .0052 .0088 .0097 .0028 -.0007 -.0002 |
|
OA2 .1192 .1575 .3228 .0076 .0043 .0086 .0103 .0045 .0007 .0006 |
|
OA3 .1132 .9231 .4366 .0084 .0057 .0087 .0105 .0027 .0010 -.0012 |
|
OA4 .1191 .0137 .7329 .0082 .0055 .0081 .0112 .0037 .0009 -.0007 |
|
OA5 .1328 .7905 .8529 .0083 .0060 .0075 .0106 .0023 .0005 -.0014 |
|
OA6 .0957 .8318 .1282 .0092 .0080 .0057 .0131 .0030 .0012 .0009 |
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OB1 .1298 .3200 .9013 .0100 .0098 .0089 .0112 .0024 .0008 -.0042 |
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OB2 .1257 .2364 .6097 .0087 .0082 .0085 .0090 .0021 -.0009 -.0048 |
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OB3 .1319 .7130 .5867 .0100 .0080 .0084 .0118 .0014 .0018 .0011 |
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OB4 .1265 .3806 .1801 .0103 .0102 .0104 .0091 .0008 .0007 -.0043 |
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OC1 .1705 .4681 .7775 .0083 .0081 .0091 .0067 .0026 .0005 .0015 |
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OC2 .1592 .4605 .5639 .0086 .0071 .0107 .0102 .0072 -.0005 -.0019 |
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OC3 .1668 .5349 .3850 .0088 .0074 .0132 .0061 .0036 .0004 -.0015 |
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OC4 .1573 .6425 .2199 .0079 .0068 .0088 .0096 .0054 .0015 .0008 |
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OC5 .1460 .5905 .9947 .0091 .0072 .0093 .0073 -.0011 .0002 .0002 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Rhodonite |
|
Nelson W R, Griffen D T |
|
American Mineralogist 90 (2005) 969-983 |
|
Crystal chemistry of Zn-rich rhodonite ("fowlerite") |
|
Sample: 15-4040 |
|
Note: see samples 15-4029 and 15-4024 for plausible typical fowlerite |
|
and rhodonite cation distributions |
|
_database_code_amcsd 0003788 |
|
9.8719 10.5262 12.2214 108.743 103.728 82.049 C-1 |
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atom x y z Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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Mn1 -.00133 .03117 .14679 .0060 .0071 .0055 .0074 .0042 .0038 .0023 |
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Mn2 .00086 .12602 .44416 .0064 .0074 .0069 .0069 .0045 .0035 .0022 |
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Mn3 .01677 .20416 .72909 .0062 .0081 .0058 .0064 .0034 .0037 .0019 |
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Zn4 .06627 .26327 .02146 .0096 .0167 .0073 .0053 .0044 -.0001 -.0008 |
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Ca5 .99385 .35827 .30602 .0096 .0096 .0098 .0134 .0073 .0062 .0014 |
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Si1 .2052 .4494 .9112 .0047 .0051 .0058 .0046 .0034 .0025 .0018 |
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Si2 .2131 .3665 .6536 .0042 .0048 .0047 .0053 .0044 .0026 .0016 |
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Si3 .2179 .5797 .5286 .0044 .0050 .0057 .0040 .0036 .0020 .0020 |
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Si4 .2139 .5059 .2591 .0048 .0049 .0065 .0053 .0049 .0023 .0019 |
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Si5 .2028 .7006 .1238 .0051 .0057 .0056 .0057 .0043 .0030 .0029 |
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OA1 .1275 .0726 .0401 .0079 .0063 .0099 .0085 .0046 .0017 .0016 |
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OA2 .1189 .1582 .3227 .0066 .0043 .0080 .0090 .0051 .0025 .0027 |
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OA3 .1139 .9232 .4367 .0073 .0047 .0074 .0097 .0040 .0005 .0015 |
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OA4 .1198 .0137 .7330 .0070 .0059 .0074 .0105 .0065 .0045 .0040 |
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OA5 .1332 .7899 .8525 .0079 .0073 .0090 .0093 .0055 .0031 .0016 |
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OA6 .0954 .8321 .1283 .0085 .0105 .0047 .0126 .0058 .0056 .0050 |
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OB1 .1301 .3191 .9010 .0090 .0120 .0101 .0075 .0042 .0029 -.0038 |
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OB2 .1258 .2360 .6103 .0083 .0104 .0076 .0085 .0040 .0017 -.0024 |
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OB3 .1313 .7122 .5869 .0103 .0097 .0090 .0107 .0015 .0042 .0040 |
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OB4 .1261 .3806 .1805 .0103 .0126 .0105 .0084 .0020 .0028 -.0035 |
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OC1 .1702 .4681 .7774 .0072 .0106 .0087 .0039 .0032 .0043 .0024 |
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OC2 .1591 .4595 .5638 .0079 .0086 .0109 .0085 .0080 .0034 .0004 |
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OC3 .1664 .5352 .3851 .0085 .0100 .0134 .0039 .0050 .0028 .0009 |
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OC4 .1571 .6428 .2201 .0071 .0078 .0098 .0071 .0070 .0042 .0035 |
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OC5 .1449 .5902 .9948 .0079 .0097 .0088 .0049 .0024 .0025 .0033 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Rhodonite |
|
Nelson W R, Griffen D T |
|
American Mineralogist 90 (2005) 969-983 |
|
Crystal chemistry of Zn-rich rhodonite ("fowlerite") |
|
Sample: 15-4041 |
|
Note: see samples 15-4029 and 15-4024 for plausible typical fowlerite |
|
and rhodonite cation distributions |
|
_database_code_amcsd 0003789 |
|
9.8905 10.5423 12.2294 108.739 103.773 82.050 C-1 |
|
atom x y z Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
Mn1 -.00130 .03113 .14693 .0056 .0071 .0055 .0074 .0042 .0038 .0023 |
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Mn2 .00087 .12580 .44409 .0056 .0074 .0069 .0069 .0045 .0035 .0022 |
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Mn3 .01664 .20497 .72913 .0057 .0081 .0058 .0064 .0034 .0037 .0019 |
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Zn4 .06617 .26347 .02144 .0091 .0167 .0073 .0053 .0044 -.0001 -.0008 |
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Ca5 .99374 .35973 .30711 .0074 .0096 .0098 .0134 .0073 .0062 .0014 |
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Si1 .20513 .44941 .91111 .0046 .0051 .0058 .0046 .0034 .0025 .0018 |
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Si2 .21346 .36663 .65328 .0037 .0048 .0047 .0053 .0044 .0026 .0016 |
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Si3 .21825 .58031 .52835 .0038 .0050 .0057 .0040 .0036 .0020 .0020 |
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Si4 .21433 .50576 .25898 .0043 .0049 .0065 .0053 .0049 .0023 .0019 |
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Si5 .20267 .70038 .12354 .0044 .0057 .0056 .0057 .0043 .0030 .0029 |
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OA1 .1275 .0724 .0400 .0065 .0063 .0099 .0085 .0046 .0017 .0016 |
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OA2 .1192 .1576 .3230 .0065 .0043 .0080 .0090 .0051 .0025 .0027 |
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OA3 .1135 .9229 .4367 .0064 .0047 .0074 .0097 .0040 .0005 .0015 |
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OA4 .1192 .0137 .7328 .0070 .0059 .0074 .0105 .0065 .0045 .0040 |
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OA5 .1333 .7905 .8531 .0071 .0073 .0090 .0093 .0055 .0031 .0016 |
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OA6 .0955 .8310 .1281 .0076 .0105 .0047 .0126 .0058 .0056 .0050 |
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OB1 .1303 .3206 .9018 .0086 .0120 .0101 .0075 .0042 .0029 -.0038 |
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OB2 .1261 .2364 .6095 .0083 .0104 .0076 .0085 .0040 .0017 -.0024 |
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OB3 .1320 .7128 .5868 .0082 .0097 .0090 .0107 .0015 .0042 .0040 |
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OB4 .1264 .3802 .1799 .0087 .0126 .0105 .0084 .0020 .0028 -.0035 |
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OC1 .1705 .4683 .7774 .0072 .0106 .0087 .0039 .0032 .0043 .0024 |
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OC2 .1593 .4607 .5640 .0070 .0086 .0109 .0085 .0080 .0034 .0004 |
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OC3 .1665 .5352 .3851 .0071 .0100 .0134 .0039 .0050 .0028 .0009 |
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OC4 .1574 .6417 .2196 .0067 .0078 .0098 .0071 .0070 .0042 .0035 |
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OC5 .1459 .5906 .9948 .0079 .0097 .0088 .0049 .0024 .0025 .0033 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
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