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Rapidcreekite |
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Onac B P, Effenberger H S, Wynn J G, Povara I |
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American Mineralogist 98 (2013) 1302-1309 |
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Rapidcreekite in the sulfuric acid weathering environment of Diana Cave, Romania |
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Locality: Diana Cave, Romania |
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_database_code_amcsd 0019905 |
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15.524 19.218 6.161 90 90 90 Pcnb |
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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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Ca1 .334002 .289513 .20090 .01712 .01787 .01618 .01733 -.00035 -.00016 -.00086 |
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Ca2 .327543 .053335 .18898 .01655 .01821 .01593 .01552 .00052 .00018 .00084 |
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S .16871 .419309 .02690 .01621 .01788 .01490 .01584 -.00009 .00004 -.00090 |
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C .19103 .17345 .4337 .0165 .0175 .0180 .0140 -.0001 -.0007 .0000 |
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O1 .22452 .35836 .04875 .0250 .0278 .0202 .0268 .0069 -.0030 .0006 |
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O2 .21343 .23291 .35720 .0204 .0235 .0166 .0212 -.0019 .0030 .0020 |
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O3 .38966 .40374 .34196 .0239 .0254 .0229 .0235 -.0011 .0063 -.0039 |
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O4 .37085 .17133 .07484 .0191 .0193 .0193 .0187 -.0009 -.0034 .0004 |
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O5 .22870 .11704 .38274 .0243 .0299 .0191 .0239 .0048 .0093 .0012 |
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O6 .28117 .48285 .48411 .0228 .0255 .0186 .0243 .0045 -.0050 -.0012 |
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O7 .11778 .43255 .22415 .0242 .0277 .0232 .0217 -.0029 .0070 -.0031 |
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OW1 .08933 .23878 .0107 .0274 .0269 .0318 .0235 -.0040 .0000 .0007 |
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OW2 .04803 .32244 .4660 .0296 .0243 .0308 .0336 .0004 -.0049 .0061 |
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OW3 .07520 .02078 .3958 .0252 .0247 .0274 .0236 -.0006 -.0004 -.0041 |
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OW4 .43354 .09068 .4675 .0288 .0250 .0334 .0280 -.0018 -.0040 .0030 |
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H1 .0414 .2390 .033 .045 |
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H2 .1182 .2440 .116 .045 |
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H3 .003 .3337 .485 .045 |
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H4 .0623 .3598 .402 .045 |
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H5 .0372 .0193 .427 .045 |
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H6 .0906 -.0138 .338 .045 |
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H7 .4914 .1012 .425 .045 |
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H8 .437 .0917 .553 .045 |
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| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
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Rapidcreekite |
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Cooper M A, Hawthorne F C |
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The Canadian Mineralogist 34 (1996) 99-106 |
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The crystal structure of rapidcreekite, Ca2(SO4)(CO3)(H2O)4, |
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and its relation to the structure of gypsum |
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_database_code_amcsd 0005481 |
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15.517 19.226 6.1646 90 90 90 Pcnb |
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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) |
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Ca1 .3341 .2896 .2009 .0129 .0106 .0140 .0001 .0005 -.0005 |
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Ca2 .3276 .0533 .1883 .0133 .0098 .0149 -.0003 .0004 -.0002 |
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S .1688 .4193 .0268 .0140 .0099 .0143 -.0020 -.0013 -.0021 |
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C .1914 .1739 .431 .0106 .0113 .0120 .0039 -.0024 -.0012 |
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O1 .2247 .3589 .050 .0180 .0158 .0250 .0080 -.0069 .0032 |
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O2 .2137 .2329 .357 .0185 .0090 .0175 -.0069 .0051 .0002 |
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O3 .3898 .4039 .343 .0162 .0129 .0246 -.0027 .0040 -.0034 |
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O4 .3712 .1714 .0735 .0165 .0118 .0171 .0008 -.0029 -.0037 |
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O5 .2286 .1168 .383 .0184 .0109 .0216 .0007 .0088 .0029 |
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O6 .2810 .4830 .484 .0235 .0103 .0160 .0023 -.0063 .0000 |
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O7 .1181 .4321 .222 .0203 .0202 .0158 -.0025 .0065 .0001 |
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Wat1 .0894 .2389 .013 .0186 .0231 .0248 -.0032 -.0004 -.0014 |
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Wat2 .0478 .3236 .466 .0181 .0307 .0257 -.0052 -.0079 .0046 |
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Wat3 .0746 .0196 .397 .0173 .0211 .0162 -.0053 -.0060 .0018 |
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Wat4 .4341 .0914 .469 .0140 .0233 .0226 -.0016 -.0025 .0022 |
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| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
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