American Mineralogist Crystal Structure Database

14 matching records for this search.

Melanterite
Download hom/melanterite.pdf
Peterson R C
Download cm/vol41/CM41_937.pdf
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
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
Download hom/melanterite.pdf
Peterson R C
Download cm/vol41/CM41_937.pdf
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
Locality: Richmond mine, Iron Mountain, California
_database_code_amcsd 0005867
14.060 6.505 10.943 90 105.75 90 P2_1/c
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
Download hom/melanterite.pdf
Peterson R C
Download cm/vol41/CM41_937.pdf
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
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
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
Download hom/melanterite.pdf
Peterson R C
Download cm/vol41/CM41_937.pdf
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: n73
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
O2     .8591    .037  .2865     .03697
O3     .6904   .1062  .2730      .0348
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
Download hom/melanterite.pdf
Peterson R C
Download cm/vol41/CM41_937.pdf
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
Locality: Richmond mine, Iron Mountain, California
_database_code_amcsd 0005870
14.081 6.510 10.997 90 105.63 90 P2_1/c
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
Download hom/melanterite.pdf
Peterson R C
Download cm/vol41/CM41_937.pdf
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
Download hom/melanterite.pdf
Peterson R C
Download cm/vol41/CM41_937.pdf
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
Download hom/melanterite.pdf
Peterson R C
Download cm/vol41/CM41_937.pdf
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
Locality: Richmond mine, Iron Mountain, California
_database_code_amcsd 0005873
14.080 6.498 10.955 90 105.65 90 P2_1/c
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
Download hom/melanterite.pdf
Peterson R C
Download cm/vol41/CM41_937.pdf
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
Download hom/melanterite.pdf
Peterson R C
Download cm/vol41/CM41_937.pdf
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
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
Download hom/melanterite.pdf
Peterson R C
Download cm/vol41/CM41_937.pdf
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
Download hom/melanterite.pdf
Anderson J L, Peterson R C, Swainson I P
Download cm/vol45/CM45_457.pdf
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
Download hom/melanterite.pdf
Baur W H
Download http://scripts.iucr.org/cgi-bin/openurl?genre=article&issn=0365-110X&volume=17&spage=1167
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
Download hom/melanterite.pdf
Fronczek F R, Collins S N, Chan J Y
Download http://scripts.iucr.org/cgi-bin/openurl?genre=article&issn=1600-5368&volume=57&spage=26
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
H41    .4297   .511   .193   .033
H47    .5233   .460   .243   .031
O5W   .56928 .78270 .06196 .01697  .0186  .0176  .0134  -.0043  .0022   .0000
H54    .6209   .784   .129   .036
H57    .5860   .847   .010   .045
O6W   .64607 .35354 .05669 .01744  .0132  .0203  .0181  -.0007  .0029   .0072
H61    .6967   .414  .0416   .033
H63    .6655   .280   .129   .047
O7W   .36626 .00643 .11265 .01654  .0177  .0130  .0182  -.0004  .0036  -.0011
H74    .3234   .070   .134   .039
H76    .3428  -.107  .0893   .041
Download AMC data (View Text File)
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Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
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Total number of retrieved datasets: 14
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