|
Melanterite |
 |
Peterson R C |
 |
The Canadian Mineralogist 41 (2003) 937-949 |
|
The relatinship between Cu content and distortion in the atomic structure |
|
of melanterite from the Richmond mine, Iron Mountain, California |
|
Sample: melant8 |
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Locality: Richmond mine, Iron Mountain, California |
|
_database_code_amcsd 0005866 |
|
14.04 6.502 10.952 90 105.81 90 P2_1/c |
|
atom x y z Uiso |
|
Fe1 0 0 0 |
|
Fe2 .5 0 .5 |
|
S .7732 -.0289 .3237 .0193 |
|
O1 .7960 -.0293 .4638 .029 |
|
O2 .8634 .0368 .2891 .03035 |
|
O3 .6918 .1160 .2727 .03138 |
|
O4 .7447 -.2360 .2736 .03329 |
|
Wat5 -.1117 -.1170 .0688 .05241 |
|
Wat6 .1008 -.0443 .1830 .03382 |
|
Wat7 -.0306 .2964 .0679 .03003 |
|
Wat8 .5198 -.0427 .3193 .0319 |
|
Wat9 .4311 .2862 .4411 .03301 |
|
Wat10 .3534 -.1407 .4401 .03317 |
|
Wat11 .3632 .0056 .1148 .03638 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
| |
|
Melanterite |
|
Peterson R C |
|
The Canadian Mineralogist 41 (2003) 937-949 |
|
The relatinship between Cu content and distortion in the atomic structure |
|
of melanterite from the Richmond mine, Iron Mountain, California |
|
Sample: M10b |
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Locality: Richmond mine, Iron Mountain, California |
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_database_code_amcsd 0005867 |
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14.060 6.505 10.943 90 105.75 90 P2_1/c |
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atom x y z occ Uiso |
|
Fe1 0 0 0 |
|
Fe2 .5 0 .5 .8 |
|
Cu2 .5 0 .5 .2 |
|
S .7730 -.0296 .3241 .0208 |
|
O1 .7954 -.0298 .4642 .0286 |
|
O2 .8628 .0369 .2887 .03111 |
|
O3 .6908 .1148 .2733 .0366 |
|
O4 .7459 -.2393 .2748 .03138 |
|
Wat5 -.1130 -.1152 .0689 .05025 |
|
Wat6 .1026 -.0435 .1836 .03579 |
|
Wat7 -.0304 .2958 .0669 .03217 |
|
Wat8 .5207 -.0415 .3197 .03486 |
|
Wat9 .4299 .2840 .4417 .03474 |
|
Wat10 .3527 -.1447 .4399 .03527 |
|
Wat11 .3637 .0047 .1140 .03423 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
| |
|
Melanterite |
|
Peterson R C |
|
The Canadian Mineralogist 41 (2003) 937-949 |
|
The relatinship between Cu content and distortion in the atomic structure |
|
of melanterite from the Richmond mine, Iron Mountain, California |
|
Sample: 98-rp-53 |
|
Locality: Richmond mine, Iron Mountain, California |
|
_database_code_amcsd 0005868 |
|
14.071 6.505 10.958 90 105.69 90 P2_1/c |
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atom x y z occ Uiso |
|
Fe1 0 0 0 |
|
Fe2 .5 0 .5 .5352 |
|
Cu2 .5 0 .5 .4150 |
|
Zn2 .5 0 .5 .0498 |
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S .7721 -.0316 .3246 .02783 |
|
O1 .7961 -.0318 .4646 .0358 |
|
O2 .8598 .0381 .2865 .0416 |
|
O3 .6895 .1103 .2745 .04051 |
|
O4 .7457 -.2406 .2755 .03913 |
|
Wat5 -.1129 -.1164 .0703 .05633 |
|
Wat6 .1017 -.0450 .1832 .04159 |
|
Wat7 -.0293 .2967 .0679 .03895 |
|
Wat8 .5194 -.0442 .3221 .03963 |
|
Wat9 .4304 .2761 .4410 .04206 |
|
Wat10 .3502 -.1515 .4409 .04228 |
|
Wat11 .3656 .0070 .1135 .04096 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
| |
|
Melanterite |
|
Peterson R C |
|
The Canadian Mineralogist 41 (2003) 937-949 |
|
The relatinship between Cu content and distortion in the atomic structure |
|
of melanterite from the Richmond mine, Iron Mountain, California |
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Sample: n73 |
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Locality: Richmond mine, Iron Mountain, California |
|
_database_code_amcsd 0005869 |
|
14.079 6.505 10.947 90 105.77 90 P2_1/c |
|
atom x y z occ Uiso |
|
Fe1 0 0 0 |
|
Fe2 .5 0 .5 .52 |
|
Cu2 .5 0 .5 .48 |
|
S .7725 -.0322 .3245 .02298 |
|
O1 .7951 -.0319 .4646 .02771 |
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O2 .8591 .037 .2865 .03697 |
|
O3 .6904 .1062 .2730 .0348 |
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O4 .7445 -.242 .2757 .03646 |
|
Wat5 -.1105 -.110 .0719 .05829 |
|
Wat6 .0994 -.0431 .1838 .03726 |
|
Wat7 -.0292 .2974 .0681 .0361 |
|
Wat8 .5196 -.046 .3236 .03382 |
|
Wat9 .4306 .277 .4419 .03603 |
|
Wat10 .3502 -.148 .4396 .03611 |
|
Wat11 .3656 .009 .1139 .03809 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
| |
|
Melanterite |
|
Peterson R C |
|
The Canadian Mineralogist 41 (2003) 937-949 |
|
The relatinship between Cu content and distortion in the atomic structure |
|
of melanterite from the Richmond mine, Iron Mountain, California |
|
Sample: m2 |
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Locality: Richmond mine, Iron Mountain, California |
|
_database_code_amcsd 0005870 |
|
14.081 6.510 10.997 90 105.63 90 P2_1/c |
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atom x y z occ Uiso |
|
Fe1 0 0 0 |
|
Fe2 .5 0 .5 .3034 |
|
Cu2 .5 0 .5 .172 |
|
Zn2 .5 0 .5 .5246 |
|
S .7727 -.0294 .3241 .02999 |
|
O1 .7958 -.0297 .4637 .03869 |
|
O2 .8614 .0387 .2874 .04355 |
|
O3 .6900 .1121 .2725 .04419 |
|
O4 .7452 -.2386 .2737 .0444 |
|
Wat5 -.1123 -.1167 .0702 .06171 |
|
Wat6 .1011 -.0437 .1822 .04432 |
|
Wat7 -.0290 .2961 .0683 .04278 |
|
Wat8 .5195 -.0423 .3203 .04209 |
|
Wat9 .4308 .2817 .4416 .04412 |
|
Wat10 .3528 -.1452 .4402 .04497 |
|
Wat11 .3649 .0055 .1152 .04456 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
| |
|
Melanterite |
|
Peterson R C |
|
The Canadian Mineralogist 41 (2003) 937-949 |
|
The relatinship between Cu content and distortion in the atomic structure |
|
of melanterite from the Richmond mine, Iron Mountain, California |
|
Sample: m40a |
|
Locality: Richmond mine, Iron Mountain, California |
|
_database_code_amcsd 0005871 |
|
14.077 6.497 10.949 90 105.81 90 P2_1/c |
|
atom x y z occ Uiso |
|
Fe1 0 0 0 |
|
Fe2 .5 0 .5 .22 |
|
Cu2 .5 0 .5 .78 |
|
S .7710 -.0352 .3250 .02848 |
|
O1 .7963 -.0366 .4651 .03734 |
|
O2 .8562 .0397 .2837 .04576 |
|
O3 .6879 .1027 .2768 .04148 |
|
O4 .7464 -.2423 .2749 .04099 |
|
Wat5 -.1127 -.1119 .0701 .0627 |
|
Wat6 .1016 -.0447 .1841 .04686 |
|
Wat7 -.0284 .2983 .0686 .04524 |
|
Wat8 .5183 -.0485 .3264 .04171 |
|
Wat9 .4295 .2639 .4400 .0469 |
|
Wat10 .3465 -.1626 .4419 .046 |
|
Wat11 .3691 .0086 .1131 .04074 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
| |
|
Melanterite |
|
Peterson R C |
|
The Canadian Mineralogist 41 (2003) 937-949 |
|
The relatinship between Cu content and distortion in the atomic structure |
|
of melanterite from the Richmond mine, Iron Mountain, California |
|
Sample: 98-rp-36 |
|
Locality: Richmond mine, Iron Mountain, California |
|
_database_code_amcsd 0005872 |
|
14.052 6.496 11.026 90 105.61 90 P2_1/c |
|
atom x y z occ Uiso |
|
Fe1 0 0 0 |
|
Fe2 .5 0 .5 .2118 |
|
Cu2 .5 0 .5 .1398 |
|
Zn2 .5 0 .5 .6484 |
|
S .7729 -.0301 .3239 .01485 |
|
O1 .7948 -.0324 .4639 .02366 |
|
O2 .8637 .0381 .2869 .02632 |
|
O3 .6915 .1171 .2747 .02459 |
|
O4 .7445 -.2365 .2751 .02591 |
|
Wat5 -.1128 -.120 .0712 .04184 |
|
Wat6 .1006 -.0466 .1858 .02932 |
|
Wat7 -.0307 .2936 .0692 .02335 |
|
Wat8 .5205 -.0440 .3193 .02801 |
|
Wat9 .4303 .2831 .4410 .02702 |
|
Wat10 .3525 -.14229 .4417 .02599 |
|
Wat11 .3631 .0047 .1133 .03109 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
| |
|
Melanterite |
|
Peterson R C |
|
The Canadian Mineralogist 41 (2003) 937-949 |
|
The relatinship between Cu content and distortion in the atomic structure |
|
of melanterite from the Richmond mine, Iron Mountain, California |
|
Sample: mati-19 |
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Locality: Richmond mine, Iron Mountain, California |
|
_database_code_amcsd 0005873 |
|
14.080 6.498 10.955 90 105.65 90 P2_1/c |
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atom x y z occ Uiso |
|
Fe1 0 0 0 |
|
Fe2 .5 0 .5 .117 |
|
Cu2 .5 0 .5 .450 |
|
Zn2 .5 0 .5 .433 |
|
S .7725 -.0307 .3244 .02861 |
|
O1 .7971 -.0314 .46503 .03641 |
|
O2 .8610 .0390 .2875 .04115 |
|
O3 .6898 .1115 .2741 .04241 |
|
O4 .7458 -.2395 .2757 .03928 |
|
Wat5 -.1132 -.1136 .0696 .06032 |
|
Wat6 .1009 -.0435 .1827 .04348 |
|
Wat7 -.0292 .2945 .0692 .03938 |
|
Wat8 .5198 -.0444 .3216 .04164 |
|
Wat9 .4305 .2767 .4409 .04247 |
|
Wat10 .3519 -.1483 .4408 .04362 |
|
Wat11 .3652 .0064 .1148 .04324 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
| |
|
Melanterite |
|
Peterson R C |
|
The Canadian Mineralogist 41 (2003) 937-949 |
|
The relatinship between Cu content and distortion in the atomic structure |
|
of melanterite from the Richmond mine, Iron Mountain, California |
|
Sample: mati-6 |
|
Locality: Richmond mine, Iron Mountain, California |
|
_database_code_amcsd 0005874 |
|
14.073 6.510 10.954 90 105.62 90 P2_1/c |
|
atom x y z occ Uiso |
|
Fe1 0 0 0 .9654 |
|
Zn1 0 0 0 .0346 |
|
Cu2 .5 0 .5 .2030 |
|
Zn2 .5 0 .5 .7970 |
|
S .7729 -.0298 .3239 .02769 |
|
O1 .7965 -.0299 .4645 .03726 |
|
O2 .8607 .0403 .2866 .04288 |
|
O3 .6895 .1125 .2730 .04211 |
|
O4 .7463 -.2388 .2749 .04054 |
|
Wat5 -.1118 -.1181 .0696 .05959 |
|
Wat6 .1006 -.0439 .1830 .04378 |
|
Wat7 -.0294 .2956 .0685 .04009 |
|
Wat8 .5192 -.0464 .3213 .0407 |
|
Wat9 .4316 .2788 .4415 .04181 |
|
Wat10 .3533 -.1453 .4411 .04206 |
|
Wat11 .3645 .0057 .1156 .04212 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
| |
|
Melanterite |
|
Peterson R C |
|
The Canadian Mineralogist 41 (2003) 937-949 |
|
The relatinship between Cu content and distortion in the atomic structure |
|
of melanterite from the Richmond mine, Iron Mountain, California |
|
Sample: mati-7 |
|
Locality: Richmond mine, Iron Mountain, California |
|
_database_code_amcsd 0005875 |
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14.100 6.518 10.886 90 105.76 90 P2_1/c |
|
atom x y z occ Uiso |
|
Fe1 0 0 0 .7056 |
|
Zn1 0 0 0 .2944 |
|
Cu2 .5 0 .5 .6820 |
|
Zn2 .5 0 .5 .3180 |
|
S .7718 -.0331 .3251 .02924 |
|
O1 .7979 -.0332 .4665 .03814 |
|
O2 .8580 .0388 .2845 .04364 |
|
O3 .6875 .1050 .2754 .04392 |
|
O4 .7462 -.2424 .27493 .04234 |
|
Wat5 -.1119 -.1132 .0698 .0647 |
|
Wat6 .1008 -.0448 .1825 .04593 |
|
Wat7 -.0283 .2960 .0692 .0436 |
|
Wat8 .5186 -.0489 .3238 .04094 |
|
Wat9 .4309 .2683 .4403 .04399 |
|
Wat10 .3491 -.1580 .4407 .04607 |
|
Wat11 .3676 .0088 .1148 .04363 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
| |
|
Melanterite |
|
Peterson R C |
|
The Canadian Mineralogist 41 (2003) 937-949 |
|
The relatinship between Cu content and distortion in the atomic structure |
|
of melanterite from the Richmond mine, Iron Mountain, California |
|
Sample: 91rs209c |
|
Locality: Richmond mine, Iron Mountain, California |
|
_database_code_amcsd 0005876 |
|
14.066 6.506 10.938 90 105.58 90 P2_1/c |
|
atom x y z occ Uiso |
|
Fe1 0 0 0 .6884 |
|
Zn1 0 0 0 .3116 |
|
Cu2 .5 0 .5 .0794 |
|
Zn2 .5 0 .5 .9206 |
|
S .7727 -.0284 .3236 .02792 |
|
O1 .7956 -.0280 .4650 .03756 |
|
O2 .8605 .0418 .2855 .04304 |
|
O3 .6900 .1121 .2720 .04204 |
|
O4 .7464 -.2386 .2748 .04068 |
|
Wat5 -.1112 -.1186 .0701 .06404 |
|
Wat6 .0996 -.0423 .1803 .0443 |
|
Wat7 -.0297 .2933 .0676 .0406 |
|
Wat8 .5199 -.0465 .3210 .04003 |
|
Wat9 .4319 .2819 .4416 .04287 |
|
Wat10 .3546 -.1425 .4413 .04141 |
|
Wat11 .3641 .0052 .1163 .04235 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
| |
|
Melanterite |
|
Anderson J L, Peterson R C, Swainson I P |
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The Canadian Mineralogist 45 (2007) 457-469 |
|
The atomic structure and hydrogen bonding of deuterated melanterite, FeSO4*7D2O |
|
Locality: synthetic |
|
_database_code_amcsd 0006145 |
|
14.0774 6.5039 11.0506 90 105.604 90 P2_1/c |
|
atom x y z occ Uiso |
|
Fe1 0 0 0 .006 |
|
Fe2 .5 .5 0 .005 |
|
S .2294 .475 .176 .007 |
|
O1 .2076 .472 .038 .034 |
|
O2 .1415 .537 .215 .015 |
|
O3 .3109 .618 .229 .016 |
|
O4 .2544 .266 .224 .026 |
|
Ow1 .116 .388 .432 .053 |
|
Ow2 .106 .954 .182 .034 |
|
Ow3 .032 .787 .432 .030 |
|
Ow4 .480 .454 .178 .036 |
|
Ow5 .433 .283 .442 .038 |
|
Ow6 .355 .855 .439 .030 |
|
Ow7 .363 .002 .108 .037 |
|
D11 .148 .262 .459 .94 .039 |
|
H11 .148 .262 .459 .06 .039 |
|
D12 .120 .428 .352 .94 .050 |
|
H12 .120 .428 .352 .06 .050 |
|
D22 .117 .816 .206 .94 .041 |
|
H22 .117 .816 .206 .06 .041 |
|
D24 .156 .050 .208 .94 .044 |
|
H24 .156 .050 .208 .06 .044 |
|
D31 .086 .874 .406 .94 .017 |
|
H31 .086 .874 .406 .06 .017 |
|
D32 .981 .882 .382 .94 .038 |
|
H32 .981 .882 .382 .06 .038 |
|
D43 .425 .520 .202 .94 .033 |
|
H43 .425 .520 .202 .06 .033 |
|
D47 .531 .464 .253 .94 .051 |
|
H47 .531 .464 .253 .06 .051 |
|
D54 .377 .286 .368 .94 .040 |
|
H54 .377 .286 .368 .06 .040 |
|
D57 .414 .309 .509 .94 .005 |
|
H57 .414 .309 .509 .06 .005 |
|
D6l .300 .919 .403 .94 .033 |
|
H6l .300 .919 .403 .06 .033 |
|
D63 .334 .774 .368 .94 .050 |
|
H63 .334 .774 .368 .06 .050 |
|
D74 .322 .080 .149 .94 .042 |
|
H74 .322 .080 .149 .06 .042 |
|
D76 .335 .884 .093 .94 .096 |
|
H76 .335 .884 .093 .06 .096 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
| |
|
Melanterite |
|
Baur W H |
 |
Acta Crystallographica 17 (1964) 1167-1174 |
|
On the crystal chemistry of salt hydrates. III. The determination of the crystal |
|
structure of FeSO4*7H2O (melanterite) |
|
Locality: synthetic |
|
_database_code_amcsd 0009289 |
|
14.072 6.503 11.041 90 105.57 90 P2_1/c |
|
atom x y z Biso B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3) |
|
Fe1 0 0 0 1.50 .0022 .0081 .0036 -.0003 .0010 -.0004 |
|
Fe2 .5 .5 0 1.50 .0020 .0105 .0028 -.0004 .0006 .0004 |
|
S .2267 .4709 .1763 1.40 .0018 .0084 .0032 -.0001 .0006 -.0005 |
|
O1 .2045 .4705 .0368 2.00 .0031 .0148 .0034 -.0015 .0011 .0002 |
|
O2 .1371 .5369 .2116 2.30 .0031 .0137 .0061 .0014 .0027 .0013 |
|
O3 .3075 .6157 .2267 2.50 .0029 .0150 .0055 -.0029 .0003 -.0033 |
|
O4 .2556 .2643 .2247 2.20 .0031 .0101 .0055 .0017 .0003 .0019 |
|
Ow1 .1129 .3853 .4322 3.70 .0065 .0238 .0076 .0073 .0052 .0042 |
|
Ow2 .1005 .9574 .1822 2.80 .0039 .0125 .0069 -.0001 .0002 .0019 |
|
Ow3 .0305 .7937 .4323 2.30 .0030 .0104 .0058 -.0010 .0005 .0013 |
|
Ow4 .4797 .4590 .1797 2.40 .0030 .0207 .0034 .0000 .0012 .0008 |
|
Ow5 .4313 .2850 .4418 2.70 .0042 .0168 .0049 .0031 .0011 .0005 |
|
Ow6 .3536 .8594 .4404 2.50 .0026 .0171 .0065 -.0009 .0007 -.0042 |
|
Ow7 .3637 .0048 .1142 2.70 .0041 .0112 .0069 .0002 .0009 -.0019 |
|
H1 .148 .259 .461 |
|
H2 .126 .428 .354 |
|
H3 .124 .817 .196 |
|
H4 .156 .051 .198 |
|
H5 .090 .870 .469 |
|
H6 .979 .887 .387 |
|
H7 .421 .514 .198 |
|
H8 .536 .475 .253 |
|
H9 .375 .275 .369 |
|
H10 .413 .359 .508 |
|
H11 .297 .910 .465 |
|
H12 .331 .776 .365 |
|
H13 .313 .077 .143 |
|
H14 .334 .894 .058 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
| |
|
Melanterite |
|
Fronczek F R, Collins S N, Chan J Y |
|
Acta Crystallographica E57 (2001) i26-i27 |
|
Refinement of ferrous sulfate heptahydrate (melanterite) with |
|
low-temperature CCD data |
|
Note: T = 120 K |
|
Locality: synthetic |
|
_database_code_amcsd 0010353 |
|
13.9969 6.4803 11.0211 90 105.5959 90 P2_1/c |
|
atom x y z Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
Fe1 0 .5 .5 .01048 .01138 .01003 .01074 .00081 .00421 .00047 |
|
Fe2 .5 .5 0 .01082 .01027 .01242 .00948 -.00049 .00216 -.00016 |
|
S1 .225907 .47057 .17436 .00979 .00908 .01007 .01016 -.00007 .00246 -.00041 |
|
O1 .20391 .46976 .03470 .01296 .0138 .0148 .0104 -.0019 .0033 -.0015 |
|
O2 .13563 .53433 .21052 .01308 .0120 .0146 .0139 .0024 .0057 .0016 |
|
O3 .30711 .61746 .22568 .01529 .0131 .0163 .0161 -.0040 .0032 -.0049 |
|
O4 .25504 .26083 .22414 .01460 .0150 .0113 .0167 .0024 .0028 .0020 |
|
O1W .11878 .39585 .43692 .0220 .0270 .0233 .0205 .0136 .0146 .0112 |
|
H11 .1457 .284 .4568 .035 |
|
H12 .1220 .439 .369 .036 |
|
O2W -.09794 .45678 .31502 .01677 .0174 .0137 .0172 .0001 .0014 -.0011 |
|
H22 -.1139 .332 .2951 .042 |
|
H24 -.1478 .529 .295 .036 |
|
O3W .02900 .79563 .43354 .01622 .0148 .0120 .0191 -.0013 -.0001 .0035 |
|
H31 .0790 .876 .4570 .028 |
|
H32 -.0120 .874 .383 .042 |
|
O4W .47869 .45429 .17987 .01569 .0141 .0217 .0111 .0004 .0031 .0003 |
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H41 .4297 .511 .193 .033 |
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H47 .5233 .460 .243 .031 |
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O5W .56928 .78270 .06196 .01697 .0186 .0176 .0134 -.0043 .0022 .0000 |
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H54 .6209 .784 .129 .036 |
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H57 .5860 .847 .010 .045 |
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O6W .64607 .35354 .05669 .01744 .0132 .0203 .0181 -.0007 .0029 .0072 |
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H61 .6967 .414 .0416 .033 |
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H63 .6655 .280 .129 .047 |
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O7W .36626 .00643 .11265 .01654 .0177 .0130 .0182 -.0004 .0036 -.0011 |
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H74 .3234 .070 .134 .039 |
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H76 .3428 -.107 .0893 .041 |
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| Download AMC data (View Text File)
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View JMOL 3-D Structure (permalink) |
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Melanterite |
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Mauro D, Biagioni C, Pasero M |
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Periodico di Mineralogia 87 (2018) 89-96 |
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Crystal-chemistry of sulfates from Apuan Alps (Tuscany, Italy). |
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I. Crystal structure and hydrogen bond system of melanterite, Fe(H2O)6(SO4)*H2O |
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Locality: Fornovolasco mine, Tuscany, Italy |
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_database_code_amcsd 0020894 |
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14.0751 6.5014 11.0426 90 105.632 90 P2_1/c |
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atom x y z occ Uiso |
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FeM1 0 0 0 .92 .02253 |
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MgM1 0 0 0 .08 .02253 |
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FeM2 .5 0 .5 .93 .02263 |
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MgM2 .5 0 .5 .07 .02263 |
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S .22670 .47165 .17616 .02070 |
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O1 .20482 .47065 .03726 .02934 |
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O2 .13742 .53708 .21196 .03089 |
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O3 .30786 .61609 .22691 .03463 |
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O4 .25466 .26373 .22602 .03302 |
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Ow1 .11233 .38395 .43126 .0526 |
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Ow2 .10036 .95775 .18169 .03791 |
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Ow3 .03025 .79316 .43223 .03415 |
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Ow4 .47936 .45868 .17967 .03343 |
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Ow5 .43178 .28426 .44160 .03549 |
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Ow6 .35472 .85897 .44106 .03622 |
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Ow7 .36367 .00531 .11505 .03607 |
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H11 .1459 .259 .450 .073 |
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H12 .1183 .432 .3527 .057 |
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H22 .1235 .823 .2041 .065 |
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H24 .1549 .047 .210 .073 |
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H31 .0878 .872 .4643 .047 |
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H32 -.0163 .876 .373 .089 |
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H43 .4187 .511 .191 .061 |
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H47 .5315 .472 .2536 .059 |
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H54 .3761 .277 .3685 .067 |
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H57 .4065 .358 .502 .095 |
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H61 .3009 .922 .4612 .056 |
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H63 .3380 .776 .3693 .067 |
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H74 .3137 .084 .137 .089 |
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H76 .3359 -.122 .080 .100 |
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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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