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Titanite |
 |
Hawthorne F C, Groat L A, Raudsepp M, Ball N A, Kimata M, Spike F D, Gaba R, |
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Halden N M, Lumpkin G R, Ewing R C, Greegor R B, Lytle F W, Ercit T S, |
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Rossman G R, Wicks F J, Ramik R A, Sherriff B L, Fleet M E, McCammon C A |
 |
American Mineralogist 76 (1991) 370-396 |
|
Alpha-decay damage in titanite |
|
sample M28658 natural from Maevatanana, Malagasy Republic |
|
_database_code_amcsd 0001353 |
|
6.549 8.695 7.060 90 113.87 90 C2/c |
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atom x y z U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
Ca 0 .1677 .75 .0072 .0071 .0254 0 -.0005 0 |
|
Ti 0 .5 0 .0047 .0081 .0178 -.0002 .0017 .0045 |
|
Si 0 .1828 .25 .0042 .0059 .0070 0 .0019 0 |
|
O1 0 .5714 .25 .0118 .0083 .0082 0 .0055 0 |
|
O2 .1855 .0663 .4102 .0057 .0090 .0110 .0007 .0020 .0017 |
|
O3 .1025 .2893 .1185 .0068 .0088 .0098 .0001 .0037 .0008 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Titanite |
|
Hawthorne F C, Groat L A, Raudsepp M, Ball N A, Kimata M, Spike F D, Gaba R, |
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Halden N M, Lumpkin G R, Ewing R C, Greegor R B, Lytle F W, Ercit T S, |
|
Rossman G R, Wicks F J, Ramik R A, Sherriff B L, Fleet M E, McCammon C A |
|
American Mineralogist 76 (1991) 370-396 |
|
Alpha-decay damage in titanite |
|
sample M28658 annealed at 1090 C, from Maevatanana, Malagasy Republic |
|
_database_code_amcsd 0001354 |
|
6.539 8.692 7.037 90 113.79 90 C2/c |
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atom x y z U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
Ca 0 .1681 .75 .0070 .0055 .0233 0 -.0010 0 |
|
Ti 0 .5 0 .0048 .0059 .0145 .0001 .0018 .0047 |
|
Si 0 .1830 .25 .0046 .0034 .0055 0 .0017 0 |
|
O1 0 .5706 .25 .0145 .0071 .0058 0 .0056 0 |
|
O2 .1854 .0666 .4107 .0065 .0071 .0099 .0005 .0015 .0010 |
|
O3 .1024 .2896 .1177 .0064 .0064 .0074 .0022 .0031 .0033 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Titanite |
|
Hawthorne F C, Groat L A, Raudsepp M, Ball N A, Kimata M, Spike F D, Gaba R, |
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Halden N M, Lumpkin G R, Ewing R C, Greegor R B, Lytle F W, Ercit T S, |
|
Rossman G R, Wicks F J, Ramik R A, Sherriff B L, Fleet M E, McCammon C A |
|
American Mineralogist 76 (1991) 370-396 |
|
Alpha-decay damage in titanite |
|
sample E2312 natural, from Sebastapol Twp., Ontario |
|
_database_code_amcsd 0001355 |
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6.554 8.708 7.069 90 113.93 90 C2/c |
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atom x y z U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
Ca 0 .1675 .75 .0090 .0072 .0309 0 -.0013 0 |
|
Ti 0 .5 0 .0072 .0087 .0174 .0041 .0025 .0000 |
|
Si 0 .1830 .25 .0065 .0064 .0078 0 .0025 0 |
|
O1 0 .5719 .25 .0127 .0081 .0087 0 .0047 0 |
|
O2 .1855 .0665 .4104 .0082 .0107 .0126 .0018 .0015 .0006 |
|
O3 .1027 .2897 .1186 .0098 .0093 .0128 .0018 .0052 .0009 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Titanite |
|
Hawthorne F C, Groat L A, Raudsepp M, Ball N A, Kimata M, Spike F D, Gaba R, |
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Halden N M, Lumpkin G R, Ewing R C, Greegor R B, Lytle F W, Ercit T S, |
|
Rossman G R, Wicks F J, Ramik R A, Sherriff B L, Fleet M E, McCammon C A |
|
American Mineralogist 76 (1991) 370-396 |
|
Alpha-decay damage in titanite |
|
sample E2312 annealed at 1090 C, from Sebastapol Twp., Ontario |
|
_database_code_amcsd 0001356 |
|
6.547 8.695 7.059 90 113.94 90 C2/c |
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atom x y z U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
Ca 0 .1673 .75 .0076 .0061 .0269 0 -.0005 0 |
|
Ti 0 .5 0 .0047 .0064 .0152 .0044 .0021 -.0001 |
|
Si 0 .1832 .25 .0052 .0050 .0069 0 .0024 0 |
|
O1 0 .5717 .25 .0102 .0056 .0072 0 .0049 0 |
|
O2 .1857 .0665 .4108 .0070 .0071 .0112 .0012 .0024 .0005 |
|
O3 .1030 .2896 .1188 .0076 .0065 .0094 .0015 .0039 .0008 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Titanite |
|
Hawthorne F C, Groat L A, Raudsepp M, Ball N A, Kimata M, Spike F D, Gaba R, |
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Halden N M, Lumpkin G R, Ewing R C, Greegor R B, Lytle F W, Ercit T S, |
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Rossman G R, Wicks F J, Ramik R A, Sherriff B L, Fleet M E, McCammon C A |
|
American Mineralogist 76 (1991) 370-396 |
|
Alpha-decay damage in titanite |
|
sample M28173 natural, from Gjerstad, Norway |
|
_database_code_amcsd 0001357 |
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6.564 8.719 7.057 90 113.79 90 C2/c |
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atom x y z U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
Ca 0 .1686 .75 .0105 .0086 .0336 0 -.0022 0 |
|
Ti 0 .5 0 .0105 .0123 .0200 .0036 .0036 .0004 |
|
Si 0 .1827 .25 .0094 .0084 .0102 0 .0036 0 |
|
O1 0 .5717 .25 .0163 .0124 .0138 0 .0057 0 |
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O2 .1851 .0660 .4103 .0117 .0149 .0170 .0019 .0024 -.0004 |
|
O3 .1033 .2895 .1188 .0130 .0130 .0169 .0022 .0060 .0016 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Titanite |
|
Hawthorne F C, Groat L A, Raudsepp M, Ball N A, Kimata M, Spike F D, Gaba R, |
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Halden N M, Lumpkin G R, Ewing R C, Greegor R B, Lytle F W, Ercit T S, |
|
Rossman G R, Wicks F J, Ramik R A, Sherriff B L, Fleet M E, McCammon C A |
|
American Mineralogist 76 (1991) 370-396 |
|
Alpha-decay damage in titanite |
|
sample M28173 annealed at 1090 C, from Gjerstad, Norway |
|
_database_code_amcsd 0001358 |
|
6.538 8.699 7.044 90 113.76 90 C2/c |
|
atom x y z U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
Ca 0 .1678 .75 .0061 .0058 .0240 0 -.0018 0 |
|
Ti 0 .5 0 .0055 .0076 .0134 .0036 .0018 -.0001 |
|
Si 0 .1828 .25 .0060 .0058 .0071 0 .0022 0 |
|
O1 0 .5727 .25 .0111 .0089 .0065 0 .0035 0 |
|
O2 .1850 .0658 .4113 .0084 .0105 .0170 .0021 .0025 .0011 |
|
O3 .1035 .2892 .1187 .0104 .0084 .0169 .0027 .0059 .0010 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Titanite |
|
Hawthorne F C, Groat L A, Raudsepp M, Ball N A, Kimata M, Spike F D, Gaba R, |
|
Halden N M, Lumpkin G R, Ewing R C, Greegor R B, Lytle F W, Ercit T S, |
|
Rossman G R, Wicks F J, Ramik R A, Sherriff B L, Fleet M E, McCammon C A |
|
American Mineralogist 76 (1991) 370-396 |
|
Alpha-decay damage in titanite |
|
sample from Cardiff U Mine, Ontario, natural |
|
_database_code_amcsd 0001359 |
|
6.607 8.775 7.110 90 114.08 90 C2/c |
|
atom x y z U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
Ca 0 .1687 .75 .0173 .0165 .0566 0 -.0041 0 |
|
Ti 0 .5 0 .0202 .0245 .0405 .0049 .0056 .0015 |
|
Si 0 .1835 .25 .0171 .0190 .0241 0 .0049 0 |
|
O1 0 .5709 .25 .0227 .0218 .0283 0 .0061 0 |
|
O2 .1859 .0664 .4094 .0217 .0274 .0316 .0026 .0039 -.0007 |
|
O3 .1019 .2904 .1194 .0198 .0257 .0322 .0031 .0079 .0033 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Titanite |
|
Hawthorne F C, Groat L A, Raudsepp M, Ball N A, Kimata M, Spike F D, Gaba R, |
|
Halden N M, Lumpkin G R, Ewing R C, Greegor R B, Lytle F W, Ercit T S, |
|
Rossman G R, Wicks F J, Ramik R A, Sherriff B L, Fleet M E, McCammon C A |
|
American Mineralogist 76 (1991) 370-396 |
|
Alpha-decay damage in titanite |
|
sample from Cardiff U Mine, Ontario, annealed at 1090 C |
|
_database_code_amcsd 0001360 |
|
6.530 8.677 7.048 90 113.91 90 C2/c |
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atom x y z U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
Ca 0 .1669 .75 .0016 .0001 .0194 0 -.0033 0 |
|
Ti 0 .5 0 .0039 .0053 .0144 -.0001 .0018 .0049 |
|
Si 0 .1835 .25 .0023 .0010 .0024 0 .0016 0 |
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O1 0 .5725 .25 .0070 .0018 .0001 0 .0000 0 |
|
O2 .1877 .0668 .4115 .0007 .0054 .0065 -.0009 .0000 .0010 |
|
O3 .1034 .2904 .1186 .0032 .0019 .0059 .0012 .0023 .0015 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Clarkeite |
|
Finch R J, Ewing R C |
|
American Mineralogist 82 (1997) 607-619 |
|
Clarkeite: New chemical and structural data |
|
_database_code_amcsd 0001902 |
|
3.954 3.954 17.660 90 90 120 R-3m |
|
atom x y z Biso |
|
U 0 0 0 .29 |
|
Na 0 0 .5 .54 |
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O1 0 0 .1069 .42 |
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O2 0 0 .3488 .42 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Schoepite |
|
Finch R J, Cooper M A, Hawthorne F C, Ewing R C |
|
The Canadian Mineralogist 34 (1996) 1071-1088 |
|
The crystal structure of schoepite, [(UO2)8O2(OH)12](H2O)12 |
|
_database_code_amcsd 0005517 |
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14.337 16.813 14.731 90 90 90 P2_1ca |
|
atom x y z Uiso |
|
U1 .2591 .5132 .7583 .0111 |
|
U2 .0276 .3775 .7628 .0136 |
|
U3 .2792 .7451 .7474 .0123 |
|
U4 -.0008 .6127 .7497 .0122 |
|
U5 .2797 .0134 .7406 .0100 |
|
U6 .0117 .8772 .7631 .0071 |
|
U7 .2607 .2450 .7520 .0084 |
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U8 .0398 .1132 .7500 .0084 |
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O1 .2786 .5016 .6402 .0150 |
|
O2 .2473 .5218 .8791 .0077 |
|
O3 .0229 .3409 .6490 .0160 |
|
O4 .0302 .4156 .8724 .0109 |
|
O5 .2344 .7381 .6367 .0215 |
|
O6 .3262 .7618 .8593 .0113 |
|
O7 .0162 .6487 .6383 .0429 |
|
O8 -.0041 .5815 .8689 .0099 |
|
O9 .3063 .0221 .6248 .0198 |
|
O10 .2575 -.0092 .8559 .0236 |
|
O11 .0124 .9067 .8803 .0142 |
|
O12 .0057 .8446 .6484 .0151 |
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O13 .2249 .2533 .6364 .0256 |
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O14 .2980 .2352 .8685 .0182 |
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O15 .0431 .0800 .8616 .0203 |
|
O16 .0345 .1425 .6332 .0063 |
|
O17 -.1530 .6265 .7408 .0103 |
|
O18 .1985 .1205 .7619 .0103 |
|
OH1 .3412 .8803 .7036 .0094 |
|
OH2 .4180 .4814 .7885 .0111 |
|
OH3 .1612 .6457 .7802 .0123 |
|
OH4 .1578 .8270 .7948 .0141 |
|
OH5 -.0372 .7429 .7985 .0084 |
|
OH6 .1026 .5020 .7041 .0087 |
|
OH7 .2083 .3751 .7845 .0094 |
|
OH8 .1222 -.0209 .7053 .0111 |
|
OH9 .3835 .1501 .7099 .0123 |
|
OH10 .3881 .3213 .6980 .0141 |
|
OH11 .0907 .2490 .8053 .0084 |
|
OH12 .4422 -.0010 .7811 .0087 |
|
Wat1 .3221 -.1226 .5227 .0291 |
|
Wat2 .4091 .5197 .4790 .0189 |
|
Wat3 .1703 .3499 .4761 .0169 |
|
Wat4 .1874 .1324 .4837 .0276 |
|
Wat5 .4822 .7469 .5139 .0420 |
|
Wat6 .1038 .5038 .5341 .0209 |
|
Wat7 .2434 .6184 .4811 .0330 |
|
Wat8 .1451 -.0423 .5225 .0501 |
|
Wat9 .3871 .1600 .5295 .0456 |
|
Wat10 .3595 .3528 .5145 .0329 |
|
Wat11 .0895 .7612 .4862 .0493 |
|
Wat12 .4307 .0066 .4664 .0194 |
|
|
| Download AMC data (View Text File)
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|
| |
|
Rutherfordine |
|
Finch R J, Cooper M A, Hawthorne F C, Ewing R C |
|
The Canadian Mineralogist 37 (1999) 929-938 |
|
Refinement of the crystal structure of rutherfordine |
|
_database_code_amcsd 0005627 |
|
4.840 9.273 4.298 90 90 90 Imm2 |
|
atom x y z U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
U 0 0 0 .0055 .0312 .0076 0 0 0 |
|
C 1/2 0 .3864 .0120 .0285 .0097 0 0 0 |
|
O1 0 -.1880 -.0049 .0309 .0279 .0263 0 0 .0027 |
|
O2 .2638 0 .5066 .0083 .0448 .0166 0 .0039 0 |
|
O3 1/2 0 .0795 .0104 .0979 .0090 0 0 0 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Billietite |
|
Finch R J, Burns P C, Hawthorne F C, Ewing R C |
|
The Canadian Mineralogist 44 (2006) 1197-1205 |
|
Refinement of the crystal structure of billietite, Ba [(UO2)6 O4 (OH)6] (H2O)8 |
|
Locality: Shaba, Democratic Republic of Congo |
|
_database_code_amcsd 0006120 |
|
12.0941 30.211 7.1563 90 90 90 Pbn2_1 |
|
atom x y z Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
Ba .63786 .87627 .3155 .0206 .0185 .0213 .0220 -.0011 .0003 .0005 |
|
U1 .55842 .74671 .00092 .0110 .0093 .0153 .0084 -.0003 -.0001 -.0001 |
|
U2 .74723 .73833 .5391 .0116 .0079 .0154 .0115 -.0001 -.0005 .0006 |
|
U3 .93753 .74265 .99884 .0108 .0083 .0156 .0085 .0006 -.0001 -.0005 |
|
U4 .55865 .00466 .01958 .0113 .0091 .0172 .0076 -.0004 -.0005 -.0004 |
|
U5 .94118 .00557 .01401 .0115 .0093 .0173 .0079 .0003 .0004 -.0005 |
|
U6 .74929 .01411 .4481 .0113 .0067 .0166 .0104 .0002 .0000 -.0006 |
|
O1 .5213 .6903 .952 .0200 |
|
O2 .5990 .8024 .058 .0176 |
|
O3 .7431 .6804 .599 .0183 |
|
O4 .7464 .7936 .445 .0171 |
|
O5 .9753 .6866 .952 .0169 |
|
O6 .8993 .7983 .052 .0202 |
|
O7 .6062 .9477 .032 .0232 |
|
O8 .5115 .0616 .011 .0166 |
|
O9 .8965 .9494 .980 .0230 |
|
O10 .9835 .0624 .039 .0190 |
|
O11 .7381 .9538 .473 .0194 |
|
O12 .7547 .0733 .432 .0116 |
|
OH13 .6016 .7238 .322 .0139 |
|
O14 .5935 .7558 .691 .0157 |
|
O15 .9038 .7496 .688 .0107 |
|
OH16 .8912 .7211 .322 .0139 |
|
OH17 .7464 .7244 .968 .0184 |
|
O18 .5779 .0136 .326 .0166 |
|
OH19 .6147 .0210 .697 .0137 |
|
OH20 .8880 .0229 .691 .0128 |
|
O21 .9161 .0043 .325 .0205 |
|
OH22 .7492 .0272 .076 .0152 |
|
OW23 .7739 .8733 .995 .0302 |
|
OW24 .9220 .6312 .314 .0319 |
|
OW25 .4129 .8883 .202 .0327 |
|
OW26 .9179 .1144 .690 .0382 |
|
OW27 .5645 .6345 .300 .0411 |
|
OW28 .7419 .6249 .025 .0539 |
|
OW29 .634 .8602 .696 .0523 |
|
OW30 .864 .8755 .390 .0452 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Wyartite |
|
Hawthorne F C, Finch R J, Ewing R C |
|
The Canadian Mineralogist 44 (2006) 1379-1385 |
|
The crystal structure of dehydrated wyartite, Ca(CO3)[U5+(U6+O2)2O4(OH)] |
|
(H2O)3 |
|
Locality: Shinkolobwe mine, Shaba, Democratic Republic of Congo |
|
_database_code_amcsd 0006129 |
|
11.2610 7.0870 16.8359 90 90 90 Pmcn |
|
atom x y z occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
Ca1 .25 .2881 .4443 .70 .0343 .0312 .051 .020 0 0 .004 |
|
Ca2 .25 .3941 .4537 .30 .019 .029 .022 .006 0 0 .003 |
|
U1 -.06061 .88930 .26385 .0113 .0077 .0072 .0190 -.0001 .0013 -.0008 |
|
U2 .25 .89101 .20930 .0112 .0064 .0075 .0198 0 0 -.0011 |
|
C .25 .6211 .5337 .70 .040 .031 .014 .076 0 0 .017 |
|
O1 .1166 .3712 .3367 .024 .014 .032 .026 -.005 .000 .007 |
|
O2 -.0055 .9067 .3647 .0242 .027 .026 .020 -.006 .004 -.003 |
|
O3 .1087 .7068 .2326 .0213 .009 .014 .041 .002 .001 -.001 |
|
O4 .1032 .0698 .2212 .0165 .014 .009 .026 .000 .003 .003 |
|
O5 -.25 .8874 .3158 .0190 .005 .027 .025 0 0 .004 |
|
Wat1 .25 .9314 .3555 .042 .057 .057 .012 0 0 -.000 |
|
O7c .25 .626 .4588 .70 .072 .081 .089 .044 0 0 -.004 |
|
OH7 .25 .626 .4588 .30 .072 .081 .089 .044 0 0 -.004 |
|
O8c .25 .468 .5723 .70 .097 .109 .105 .077 0 0 .050 |
|
OH8 .25 .468 .5723 .30 .097 .109 .105 .077 0 0 .050 |
|
O9Ac .25 .745 .5852 .70 .083 |
|
O9B .25 .074 .511 .30 .083 |
|
Wat2 .0530 .222 .4848 .33 .030 |
|
|
| Download AMC data (View Text File)
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|
| |
|
Thorite |
|
Taylor M, Ewing R C |
 |
Acta Crystallographica B34 (1978) 1074-1079 |
|
The crystal structure of the ThSiO4 polymorphs: huttonite and thorite |
|
Locality: synthetic |
|
_database_code_amcsd 0009633 |
|
7.1328 7.1328 6.3188 90 90 90 *I4_1/amd |
|
0 -.25 .125 |
|
atom x y z Biso B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3) |
|
Th 0 .75 .125 .30 .0016 .0016 .0015 0 0 0 |
|
Si 0 .75 .625 .55 |
|
O 0 .0732 .2104 .59 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Huttonite |
|
Taylor M, Ewing R C |
|
Acta Crystallographica B34 (1978) 1074-1079 |
|
The crystal structure of the ThSiO4 polymorphs: huttonite and thorite |
|
Locality: synthetic |
|
_database_code_amcsd 0009634 |
|
6.784 6.974 6.500 90 104.92 90 P2_1/n |
|
atom x y z Biso B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3) |
|
Th .2828 .1550 .0988 .37 .0029 .0016 .0018 -.0001 .0006 .0003 |
|
Si .3020 .1616 .6117 .46 |
|
O1 .3900 .3388 .4967 .55 |
|
O2 .4803 .1060 .8234 .49 |
|
O3 .1216 .2122 .7245 .55 |
|
O4 .2451 .4976 .0626 .85 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Ianthinite |
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Burns P C, Finch R J, Hawthorne F C, Miller M L, Ewing R C |
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Journal of Nuclear Materials 249 (1997) 199-206 |
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The crystal structure of ianthinite, [U4+2(UO2)4O6(OH)4](H2O)5: a possible |
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phase for Pu4+ incorporation during the oxidation of spent nuclear fuel |
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Locality: Shinkolobwe mine, Shaba, southern Congo |
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_database_code_amcsd 0013139 |
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7.178 11.473 30.39 90 90 90 P2_1cn |
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atom x y z occ Uiso |
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U1 0 .059 .0057 .0427 |
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U2 .012 -.249 -.0117 .0732 |
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U3 .013 -.558 .0077 .0552 |
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U4 .008 -.496 .2397 .0050 |
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U5 .005 .8140 .2567 .0040 |
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U6 .013 .1929 .2557 .0011 |
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O1 .083 .043 .061 .0050 |
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O2 -.016 .060 -.054 .0050 |
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O3 .000 -.522 .065 .0050 |
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O4 .008 -.593 -.050 .0050 |
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O5 .013 .764 .313 .0050 |
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O6 .002 .857 .200 .0050 |
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O7 .004 .218 .314 .0050 |
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O8 .008 .133 .201 .0050 |
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O9 -.169 -.111 -.004 .0050 |
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O10 -.166 -.420 -.020 .0050 |
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O11 .186 -.366 .240 .0050 |
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O12 .837 -.358 .241 .0050 |
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O13 .822 -.633 .244 .0050 |
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O14 .201 -.634 .238 .0050 |
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OHl .198 -.128 -.046 .0067 |
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OH2 .009 .234 .034 .0067 |
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OH3 .213 -.377 -.040 .0067 |
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OH4 .057 -.013 .285 .0067 |
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Wat1 .025 -.262 -.095 .0142 |
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Wat2 .014 -.519 .163 .0142 |
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Wat3 -.001 -.520 .317 .0142 |
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Wat4 .013 -.236 .066 .0142 |
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Wat5 .801 .910 .126 .0142 |
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Wat6 .226 .890 .141 .0142 |
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Wat7 .732 .090 .121 .0142 |
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Wat8 .291 .120 .134 .0142 |
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Wat9a .670 .469 .130 1/3 .0100 |
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Wat9b .858 -.470 -.128 1/3 .0100 |
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Wat9c .006 -.598 .130 1/3 .0100 |
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