American Mineralogist Crystal Structure Database

45 matching records for this search.

Pentlandite
Download hom/pentlandite.pdf
Pearson A D, Buerger M J
Download am/vol41/AM41_804.pdf
American Mineralogist 41 (1956) 804-805
Confirmation of the crystal structure of pentlandite.
_database_code_amcsd 0000079
10.030 10.030 10.030 90 90 90 Fm3m
atom    x    y    z occ
Ni1    .5   .5   .5  .5
Fe1    .5   .5   .5  .5
Ni2  .125 .125 .125  .5
Fe2  .125 .125 .125  .5
S1    .25  .25  .25
S2    .25    0    0
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Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Pentlandite
Download hom/pentlandite.pdf
Rajamani V, Prewitt C T
Download am/vol60/AM60_39.pdf
American Mineralogist 60 (1975) 39-48
Thermal expansion of the pentlandite structure
Frood, at 24 deg C
_database_code_amcsd 0000437
10.038 10.038 10.038 90 90 90 Fm3m
atom      x      y      z  occ Biso B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3)
Fe1      .5     .5     .5 .441  .55
Ni1      .5     .5     .5 .538  .55
Co1      .5     .5     .5 .008  .55
Fe2  .12608 .12608 .12608 .441  .42 .00106 .00106 .00106 .00008 .00008 .00008
Ni2  .12608 .12608 .12608 .538  .42 .00106 .00106 .00106 .00008 .00008 .00008
Co2  .12608 .12608 .12608 .008  .42 .00106 .00106 .00106 .00008 .00008 .00008
S1      .25    .25    .25       .58
S2    .2632      0      0       .42  .0009  .0011  .0011      0      0      0
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Pentlandite
Download hom/pentlandite.pdf
Rajamani V, Prewitt C T
Download am/vol60/AM60_39.pdf
American Mineralogist 60 (1975) 39-48
Thermal expansion of the pentlandite structure
Frood, at 200 deg C
_database_code_amcsd 0000438
10.158 10.158 10.158 90 90 90 Fm3m
atom     x     y     z  occ Biso B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3)
Fe1     .5    .5    .5 .441 1.37
Ni1     .5    .5    .5 .538 1.37
Co1     .5    .5    .5 .008 1.37
Fe2  .1265 .1265 .1265 .441      .00291 .00291 .00291 0.0001 0.0001 0.0001
Ni2  .1265 .1265 .1265 .538      .00291 .00291 .00291 0.0001 0.0001 0.0001
Co2  .1265 .1265 .1265 .008      .00291 .00291 .00291 0.0001 0.0001 0.0001
S1     .25   .25   .25      1.31
S2   .2598     0     0            .0023  .0030  .0030      0      0      0
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Pentlandite
Download hom/pentlandite.pdf
Rajamani V, Prewitt C T
Download am/vol60/AM60_39.pdf
American Mineralogist 60 (1975) 39-48
Thermal expansion of the pentlandite structure
Frood, at 24 deg C after heating
_database_code_amcsd 0000439
10.093 10.093 10.093 90 90 90 Fm3m
atom      x      y      z  occ Biso B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3)
Fe1      .5     .5     .5 .441  .77
Ni1      .5     .5     .5 .538  .77
Co1      .5     .5     .5 .008  .77
Fe2  .12632 .12632 .12632 .441      .00184 .00184 .00184 .00008 .00008 .00008
Ni2  .12632 .12632 .12632 .538      .00184 .00184 .00184 .00008 .00008 .00008
Co2  .12632 .12632 .12632 .008      .00184 .00184 .00184 .00008 .00008 .00008
S1      .25    .25    .25       .83
S2    .2604      0      0            .0015  .0019  .0019      0      0      0
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Pentlandite
Download hom/pentlandite.pdf
Rajamani V, Prewitt C T
Download am/vol60/AM60_39.pdf
American Mineralogist 60 (1975) 39-48
Thermal expansion of the pentlandite structure
Outokumpu, at 24 deg C
_database_code_amcsd 0000440
9.977 9.977 9.977 90 90 90 Fm3m
atom      x      y      z  occ Biso B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3)
Fe1      .5     .5     .5 .181  .55
Ni1      .5     .5     .5 .202  .55
Co1      .5     .5     .5 .619  .55
Fe2  .12617 .12617 .12617 .181      .00124 .00124 .00124 .00006 .00006 .00006
Ni2  .12617 .12617 .12617 .202      .00124 .00124 .00124 .00006 .00006 .00006
Co2  .12617 .12617 .12617 .619      .00124 .00124 .00124 .00006 .00006 .00006
S1      .25    .25    .25       .62
S2    .2623      0      0           .00093 .00138 .00138      0      0      0
Download AMC data (View Text File)
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Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Pentlandite
Download hom/pentlandite.pdf
Rajamani V, Prewitt C T
Download am/vol60/AM60_39.pdf
American Mineralogist 60 (1975) 39-48
Thermal expansion of the pentlandite structure
Outokumpu, at 235 deg C
_database_code_amcsd 0000441
10.004 10.004 10.004 90 90 90 Fm3m
atom      x      y      z  occ Biso B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3)
Fe1      .5     .5     .5 .181 1.01
Ni1      .5     .5     .5 .202 1.01
Co1      .5     .5     .5 .619 1.01
Fe2  .12626 .12626 .12626 .181      .00226 .00226 .00226  .0001  .0001  .0001
Ni2  .12626 .12626 .12626 .202      .00226 .00226 .00226  .0001  .0001  .0001
Co2  .12626 .12626 .12626 .619      .00226 .00226 .00226  .0001  .0001  .0001
S1      .25    .25    .25      1.15
S2    .2622      0      0            .0020  .0022  .0022      0      0      0
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Pentlandite
Download hom/pentlandite.pdf
Rajamani V, Prewitt C T
Download am/vol60/AM60_39.pdf
American Mineralogist 60 (1975) 39-48
Thermal expansion of the pentlandite structure
Outokumpu, at 350 deg C
_database_code_amcsd 0000442
10.031 10.031 10.031 90 90 90 Fm3m
atom      x      y      z  occ Biso B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3)
Fe1      .5     .5     .5 .181 1.24
Ni1      .5     .5     .5 .202 1.24
Co1      .5     .5     .5 .619 1.24
Fe2  .12639 .12639 .12639 .181       .0030  .0030  .0030 .00015 .00015 .00015
Ni2  .12639 .12639 .12639 .202       .0030  .0030  .0030 .00015 .00015 .00015
Co2  .12639 .12639 .12639 .619       .0030  .0030  .0030 .00015 .00015 .00015
S1      .25    .25    .25      1.41
S2    .2618      0      0            .0022  .0029  .0029      0      0      0
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Pentlandite
Download hom/pentlandite.pdf
Rajamani V, Prewitt C T
Download am/vol60/AM60_39.pdf
American Mineralogist 60 (1975) 39-48
Thermal expansion of the pentlandite structure
Outokumpu, at 24 deg C after heating
_database_code_amcsd 0000443
9.969 9.969 9.969 90 90 90 Fm3m
atom      x      y      z  occ Biso B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3)
Fe1      .5     .5     .5 .181  .66
Ni1      .5     .5     .5 .202  .66
Co1      .5     .5     .5 .619  .66
Fe2  .12615 .12615 .12615 .181       .0014  .0014  .0014 .00011 .00011 .00011
Ni2  .12615 .12615 .12615 .202       .0014  .0014  .0014 .00011 .00011 .00011
Co2  .12615 .12615 .12615 .619       .0014  .0014  .0014 .00011 .00011 .00011
S1      .25    .25    .25       .76
S2    .2624      0      0            .0014  .0014  .0014      0      0      0
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Pentlandite
Download hom/pentlandite.pdf
Tenailleau C, Etschmann B, Ibberson R M, Pring A
Download am/vol91/AM91_1442.pdf
American Mineralogist 91 (2006) 1442-1447
A neutron powder diffraction study of Fe and Ni distributions in synthetic
pentlandite and violarite using 60Ni isotope
Locality: synthetic
Sample: T = 25 C after annealing at 150 C for 1 month
_database_code_amcsd 0004226
10.1075 10.1075 10.1075 90 90 90 Fm3m
atom     x     y     z  occ  Uiso
NiO     .5    .5    .5  .57 .0053
FeO     .5    .5    .5  .43 .0053
FeT  .1274 .1274 .1274  .54 .0053
NiT  .1274 .1274 .1274  .46 .0053
S1     .25   .25   .25      .0038
S2   .2590     0     0      .0038
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Pentlandite
Download hom/pentlandite.pdf
Tenailleau C, Etschmann B, Ibberson R M, Pring A
Download am/vol91/AM91_1442.pdf
American Mineralogist 91 (2006) 1442-1447
A neutron powder diffraction study of Fe and Ni distributions in synthetic
pentlandite and violarite using 60Ni isotope
Locality: synthetic
Sample: T = 225 C
_database_code_amcsd 0004227
10.2045 10.2045 10.2045 90 90 90 Fm3m
atom     x     y     z  occ  Uiso
NiO     .5    .5    .5  .50 .0110
FeO     .5    .5    .5  .50 .0110
FeT  .1280 .1280 .1280  .53 .0110
NiT  .1280 .1280 .1280  .47 .0110
S1     .25   .25   .25      .0053
S2   .2624     0     0      .0053
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Pentlandite
Download hom/pentlandite.pdf
Tenailleau C, Etschmann B, Ibberson R M, Pring A
Download am/vol91/AM91_1442.pdf
American Mineralogist 91 (2006) 1442-1447
A neutron powder diffraction study of Fe and Ni distributions in synthetic
pentlandite and violarite using 60Ni isotope
Locality: synthetic
Sample: T = 300 C
_database_code_amcsd 0004228
10.2349 10.2349 10.2349 90 90 90 Fm3m
atom     x     y     z  occ  Uiso
NiO     .5    .5    .5  .50 .0161
FeO     .5    .5    .5  .50 .0161
FeT  .1276 .1276 .1276  .54 .0161
NiT  .1276 .1276 .1276  .46 .0161
S1     .25   .25   .25      .0099
S2   .2600     0     0      .0099
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Pentlandite
Download hom/pentlandite.pdf
Tenailleau C, Etschmann B, Ibberson R M, Pring A
Download am/vol91/AM91_1442.pdf
American Mineralogist 91 (2006) 1442-1447
A neutron powder diffraction study of Fe and Ni distributions in synthetic
pentlandite and violarite using 60Ni isotope
Locality: synthetic
Sample: T = 25 C, annealed at 150 C for t = 2 months after high-T expirement
_database_code_amcsd 0004229
10.1296 10.1296 10.1296 90 90 90 Fm3m
atom     x     y     z  occ  Uiso
NiO     .5    .5    .5  .52 .0095
FeO     .5    .5    .5  .48 .0095
FeT  .1273 .1273 .1273  .52 .0095
NiT  .1273 .1273 .1273  .48 .0095
S1     .25   .25   .25      .0081
S2   .2601     0     0      .0081
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Pentlandite
Download hom/pentlandite.pdf
Hall S R, Stewart J M
Download cm/vol12/CM12_169.pdf
The Canadian Mineralogist 12 (1973) 169-177
The crystal structure of argentian pentlandite (Fe,Ni)8AgS8, compared with
the refined structure of pentlandite (Fe,Ni)9S8
_database_code_amcsd 0005094
10.044 10.044 10.044 90 90 90 Fm3m
atom     x     y     z occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Fe1     .5    .5    .5 .47  .0077  .0077  .0077      0      0      0
Ni1     .5    .5    .5 .53  .0077  .0077  .0077      0      0      0
Fe2  .1261 .1261 .1261 .47  .0075  .0075  .0075  .0004  .0004  .0004
Ni2  .1261 .1261 .1261 .53  .0075  .0075  .0075  .0004  .0004  .0004
S1     .25   .25   .25      .0095  .0095  .0095      0      0      0
S2   .2629     0     0      .0068  .0080  .0080      0      0      0
Download AMC data (View Text File)
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View JMOL 3-D Structure (permalink)
 
Pentlandite
Download hom/pentlandite.pdf
Rajamani V, Prewitt C T
Download cm/vol12/CM12_178.pdf
The Canadian Mineralogist 12 (1973) 178-187
Crystal chemistry of natural pentlandite
Locality: Frood Mine, Ontario, Canada
_database_code_amcsd 0005095
10.038 10.038 10.038 90 90 90 Fm3m
atom      x      y      z occ Biso B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3)
FeMO     .5     .5     .5  .7  .55
NiMO     .5     .5     .5  .3  .55
NiMT .12608 .12608 .12608 .58  .42 .00106 .00106 .00106 .00008 .00008 .00008
FeMT .12608 .12608 .12608 .41  .42 .00106 .00106 .00106 .00008 .00008 .00008
S1      .25    .25    .25      .58
S2    .2632      0      0      .42  .0009  .0011  .0011      0      0      0
Download AMC data (View Text File)
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Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Pentlandite
Download hom/pentlandite.pdf
Rajamani V, Prewitt C T
Download cm/vol12/CM12_178.pdf
The Canadian Mineralogist 12 (1973) 178-187
Crystal chemistry of natural pentlandite
Locality: Outokumpu, Finland
_database_code_amcsd 0005096
9.977 9.977 9.977 90 90 90 Fm3m
atom      x      y      z occ Biso B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3)
FeMO     .5     .5     .5  .7  .55
NiMO     .5     .5     .5  .3  .55
NiMT .12617 .12617 .12617 .58  .49 .00124 .00124 .00124 .00006 .00006 .00006
FeMT .12617 .12617 .12617 .41  .49 .00124 .00124 .00124 .00006 .00006 .00006
S1      .25    .25    .25     .621
S2    .2623      0      0      .49 .00093 .00138 .00138      0      0      0
Download AMC data (View Text File)
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Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Pentlandite
Download hom/pentlandite.pdf
Tsukimura K, Nakazawa H, Endo T, Fukunaga O
 
Physics and Chemistry of Minerals 19 (1992) 203-212
Cation distribution in Pentlandites (Fe,Ni)9S8: dependence of pressure and
temperature and kinetics of the cation exchange reaction
Sample: Synthetic, Fe/(Fe+Ni) = .556, T = 293 K, P = 0 GPa
Note: structure was not refined in this study
_database_code_amcsd 0007699
10.139 10.139 10.139 90 90 90 Fm3m
atom    x    y    z  occ
Fe1    .5   .5   .5 .347
Ni1    .5   .5   .5 .653
Fe2  .125 .125 .125 .582
Ni2  .125 .125 .125 .418
S1    .25  .25  .25
S2    .25    0    0
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Pentlandite
Download hom/pentlandite.pdf
Tsukimura K, Nakazawa H, Endo T, Fukunaga O
 
Physics and Chemistry of Minerals 19 (1992) 203-212
Cation distribution in Pentlandites (Fe,Ni)9S8: dependence of pressure and
temperature and kinetics of the cation exchange reaction
Sample: Synthetic, Fe/(Fe+Ni) = .556, T = 433 K, P = 2 GPa
Note: structure was not refined in this study
_database_code_amcsd 0007700
10.121 10.121 10.121 90 90 90 Fm3m
atom    x    y    z  occ
Fe1    .5   .5   .5 .468
Ni1    .5   .5   .5 .532
Fe2  .125 .125 .125 .567
Ni2  .125 .125 .125 .433
S1    .25  .25  .25
S2    .25    0    0
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Pentlandite
Download hom/pentlandite.pdf
Tsukimura K, Nakazawa H, Endo T, Fukunaga O
 
Physics and Chemistry of Minerals 19 (1992) 203-212
Cation distribution in Pentlandites (Fe,Ni)9S8: dependence of pressure and
temperature and kinetics of the cation exchange reaction
Sample: Synthetic, Fe/(Fe+Ni) = .556, T = 523 K, P = 0 GPa
Note: structure was not refined in this study
_database_code_amcsd 0007701
10.129 10.129 10.129 90 90 90 Fm3m
atom    x    y    z  occ
Fe1    .5   .5   .5 .414
Ni1    .5   .5   .5 .586
Fe2  .125 .125 .125 .574
Ni2  .125 .125 .125 .426
S1    .25  .25  .25
S2    .25    0    0
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Pentlandite
Download hom/pentlandite.pdf
Tsukimura K, Nakazawa H, Endo T, Fukunaga O
 
Physics and Chemistry of Minerals 19 (1992) 203-212
Cation distribution in Pentlandites (Fe,Ni)9S8: dependence of pressure and
temperature and kinetics of the cation exchange reaction
Sample: Synthetic, Fe/(Fe+Ni) = .556, T = 523 K, P = 1 GPa
Note: structure was not refined in this study
_database_code_amcsd 0007702
10.128 10.128 10.128 90 90 90 Fm3m
atom    x    y    z  occ
Fe1    .5   .5   .5 .421
Ni1    .5   .5   .5 .579
Fe2  .125 .125 .125 .573
Ni2  .125 .125 .125 .427
S1    .25  .25  .25
S2    .25    0    0
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Pentlandite
Download hom/pentlandite.pdf
Tsukimura K, Nakazawa H, Endo T, Fukunaga O
 
Physics and Chemistry of Minerals 19 (1992) 203-212
Cation distribution in Pentlandites (Fe,Ni)9S8: dependence of pressure and
temperature and kinetics of the cation exchange reaction
Sample: Synthetic, Fe/(Fe+Ni) = .556, T = 523 K, P = 2 GPa
Note: structure was not refined in this study
_database_code_amcsd 0007703
10.107 10.107 10.107 90 90 90 Fm3m
atom    x    y    z  occ
Fe1    .5   .5   .5 .561
Ni1    .5   .5   .5 .439
Fe2  .125 .125 .125 .555
Ni2  .125 .125 .125 .445
S1    .25  .25  .25
S2    .25    0    0
Download AMC data (View Text File)
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Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Pentlandite
Download hom/pentlandite.pdf
Tsukimura K, Nakazawa H, Endo T, Fukunaga O
 
Physics and Chemistry of Minerals 19 (1992) 203-212
Cation distribution in Pentlandites (Fe,Ni)9S8: dependence of pressure and
temperature and kinetics of the cation exchange reaction
Sample: Synthetic, Fe/(Fe+Ni) = .556, T = 523 K, P = 2 GPa
Note: structure was not refined in this study
_database_code_amcsd 0007704
10.087 10.087 10.087 90 90 90 Fm3m
atom    x    y    z  occ
Fe1    .5   .5   .5 .697
Ni1    .5   .5   .5 .303
Fe2  .125 .125 .125 .538
Ni2  .125 .125 .125 .462
S1    .25  .25  .25
S2    .25    0    0
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Pentlandite
Download hom/pentlandite.pdf
Tsukimura K, Nakazawa H, Endo T, Fukunaga O
 
Physics and Chemistry of Minerals 19 (1992) 203-212
Cation distribution in Pentlandites (Fe,Ni)9S8: dependence of pressure and
temperature and kinetics of the cation exchange reaction
Sample: Synthetic, Fe/(Fe+Ni) = .556, T = 523 K, P = 4 GPa
Note: structure was not refined in this study
_database_code_amcsd 0007705
10.044 10.044 10.044 90 90 90 Fm3m
atom    x    y    z  occ
Fe1    .5   .5   .5 .986
Ni1    .5   .5   .5 .014
Fe2  .125 .125 .125 .502
Ni2  .125 .125 .125 .498
S1    .25  .25  .25
S2    .25    0    0
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Pentlandite
Download hom/pentlandite.pdf
Tsukimura K, Nakazawa H, Endo T, Fukunaga O
 
Physics and Chemistry of Minerals 19 (1992) 203-212
Cation distribution in Pentlandites (Fe,Ni)9S8: dependence of pressure and
temperature and kinetics of the cation exchange reaction
Sample: Synthetic, Fe/(Fe+Ni) = .556, T = 723 K, P = 1 GPa
Note: structure was not refined in this study
_database_code_amcsd 0007706
10.123 10.123 10.123 90 90 90 Fm3m
atom    x    y    z  occ
Fe1    .5   .5   .5 .455
Ni1    .5   .5   .5 .545
Fe2  .125 .125 .125 .569
Ni2  .125 .125 .125 .431
S1    .25  .25  .25
S2    .25    0    0
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Pentlandite
Download hom/pentlandite.pdf
Tsukimura K, Nakazawa H, Endo T, Fukunaga O
 
Physics and Chemistry of Minerals 19 (1992) 203-212
Cation distribution in Pentlandites (Fe,Ni)9S8: dependence of pressure and
temperature and kinetics of the cation exchange reaction
Sample: Natural, Fe/(Fe+Ni) = .470, T = 293 K, P = 0 GPa
Note: structure was not refined in this study
_database_code_amcsd 0007707
10.044 10.044 10.044 90 90 90 Fm3m
atom    x    y    z  occ
Fe1    .5   .5   .5 .700
Ni1    .5   .5   .5 .300
Fe2  .125 .125 .125 .441
Ni2  .125 .125 .125 .559
S1    .25  .25  .25
S2    .25    0    0
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Pentlandite
Download hom/pentlandite.pdf
Tsukimura K, Nakazawa H, Endo T, Fukunaga O
 
Physics and Chemistry of Minerals 19 (1992) 203-212
Cation distribution in Pentlandites (Fe,Ni)9S8: dependence of pressure and
temperature and kinetics of the cation exchange reaction
Sample: Natural, Fe/(Fe+Ni) = .470, T = 473 K, P = 0 GPa
Note: structure was not refined in this study
_database_code_amcsd 0007708
10.075 10.075 10.075 90 90 90 Fm3m
atom    x    y    z  occ
Fe1    .5   .5   .5 .492
Ni1    .5   .5   .5 .508
Fe2  .125 .125 .125 .467
Ni2  .125 .125 .125 .533
S1    .25  .25  .25
S2    .25    0    0
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Pentlandite
Download hom/pentlandite.pdf
Tsukimura K, Nakazawa H, Endo T, Fukunaga O
 
Physics and Chemistry of Minerals 19 (1992) 203-212
Cation distribution in Pentlandites (Fe,Ni)9S8: dependence of pressure and
temperature and kinetics of the cation exchange reaction
Sample: Natural, Fe/(Fe+Ni) = .470, T = 473 K, P = 0 GPa
Note: structure was not refined in this study
_database_code_amcsd 0007709
10.080 10.080 10.080 90 90 90 Fm3m
atom    x    y    z  occ
Fe1    .5   .5   .5 .458
Ni1    .5   .5   .5 .542
Fe2  .125 .125 .125 .472
Ni2  .125 .125 .125 .528
S1    .25  .25  .25
S2    .25    0    0
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Pentlandite
Download hom/pentlandite.pdf
Tsukimura K, Nakazawa H, Endo T, Fukunaga O
 
Physics and Chemistry of Minerals 19 (1992) 203-212
Cation distribution in Pentlandites (Fe,Ni)9S8: dependence of pressure and
temperature and kinetics of the cation exchange reaction
Sample: Natural, Fe/(Fe+Ni) = .470, T = 473 K, P = 0 GPa
Note: structure was not refined in this study
_database_code_amcsd 0007710
10.094 10.094 10.094 90 90 90 Fm3m
atom    x    y    z  occ
Fe1    .5   .5   .5 .364
Ni1    .5   .5   .5 .636
Fe2  .125 .125 .125 .483
Ni2  .125 .125 .125 .517
S1    .25  .25  .25
S2    .25    0    0
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Pentlandite
Download hom/pentlandite.pdf
Tsukimura K, Nakazawa H, Endo T, Fukunaga O
 
Physics and Chemistry of Minerals 19 (1992) 203-212
Cation distribution in Pentlandites (Fe,Ni)9S8: dependence of pressure and
temperature and kinetics of the cation exchange reaction
Sample: Natural, Fe/(Fe+Ni) = .470, T = 473 K, P = 0 GPa
Note: structure was not refined in this study
_database_code_amcsd 0007711
10.101 10.101 10.101 90 90 90 Fm3m
atom    x    y    z  occ
Fe1    .5   .5   .5 .317
Ni1    .5   .5   .5 .683
Fe2  .125 .125 .125 .489
Ni2  .125 .125 .125 .511
S1    .25  .25  .25
S2    .25    0    0
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Pentlandite
Download hom/pentlandite.pdf
Tsukimura K, Nakazawa H, Endo T, Fukunaga O
 
Physics and Chemistry of Minerals 19 (1992) 203-212
Cation distribution in Pentlandites (Fe,Ni)9S8: dependence of pressure and
temperature and kinetics of the cation exchange reaction
Sample: Natural, Fe/(Fe+Ni) = .470, T = 473 K, P = 0 GPa
Note: structure was not refined in this study
_database_code_amcsd 0007712
10.100 10.100 10.100 90 90 90 Fm3m
atom    x    y    z  occ
Fe1    .5   .5   .5 .324
Ni1    .5   .5   .5 .676
Fe2  .125 .125 .125 .488
Ni2  .125 .125 .125 .512
S1    .25  .25  .25
S2    .25    0    0
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Pentlandite
Download hom/pentlandite.pdf
Tsukimura K, Nakazawa H, Endo T, Fukunaga O
 
Physics and Chemistry of Minerals 19 (1992) 203-212
Cation distribution in Pentlandites (Fe,Ni)9S8: dependence of pressure and
temperature and kinetics of the cation exchange reaction
Sample: Natural, Fe/(Fe+Ni) = .470, T = 448 K, P = 0 GPa
Note: structure was not refined in this study
_database_code_amcsd 0007713
10.073 10.073 10.073 90 90 90 Fm3m
atom    x    y    z  occ
Fe1    .5   .5   .5 .506
Ni1    .5   .5   .5 .494
Fe2  .125 .125 .125 .465
Ni2  .125 .125 .125 .535
S1    .25  .25  .25
S2    .25    0    0
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Pentlandite
Download hom/pentlandite.pdf
Tsukimura K, Nakazawa H, Endo T, Fukunaga O
 
Physics and Chemistry of Minerals 19 (1992) 203-212
Cation distribution in Pentlandites (Fe,Ni)9S8: dependence of pressure and
temperature and kinetics of the cation exchange reaction
Sample: Natural, Fe/(Fe+Ni) = .470, T = 448 K, P = 0 GPa
Note: structure was not refined in this study
_database_code_amcsd 0007714
10.082 10.082 10.082 90 90 90 Fm3m
atom    x    y    z  occ
Fe1    .5   .5   .5 .445
Ni1    .5   .5   .5 .555
Fe2  .125 .125 .125 .473
Ni2  .125 .125 .125 .527
S1    .25  .25  .25
S2    .25    0    0
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Pentlandite
Download hom/pentlandite.pdf
Tsukimura K, Nakazawa H, Endo T, Fukunaga O
 
Physics and Chemistry of Minerals 19 (1992) 203-212
Cation distribution in Pentlandites (Fe,Ni)9S8: dependence of pressure and
temperature and kinetics of the cation exchange reaction
Sample: Natural, Fe/(Fe+Ni) = .470, T = 448 K, P = 0 GPa
Note: structure was not refined in this study
_database_code_amcsd 0007715
10.098 10.098 10.098 90 90 90 Fm3m
atom    x    y    z  occ
Fe1    .5   .5   .5 .337
Ni1    .5   .5   .5 .663
Fe2  .125 .125 .125 .487
Ni2  .125 .125 .125 .513
S1    .25  .25  .25
S2    .25    0    0
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Pentlandite
Download hom/pentlandite.pdf
Tsukimura K, Nakazawa H, Endo T, Fukunaga O
 
Physics and Chemistry of Minerals 19 (1992) 203-212
Cation distribution in Pentlandites (Fe,Ni)9S8: dependence of pressure and
temperature and kinetics of the cation exchange reaction
Sample: Natural, Fe/(Fe+Ni) = .470, T = 448 K, P = 0 GPa
Note: structure was not refined in this study
_database_code_amcsd 0007716
10.099 10.099 10.099 90 90 90 Fm3m
atom    x    y    z  occ
Fe1    .5   .5   .5 .331
Ni1    .5   .5   .5 .669
Fe2  .125 .125 .125 .487
Ni2  .125 .125 .125 .513
S1    .25  .25  .25
S2    .25    0    0
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Pentlandite
Download hom/pentlandite.pdf
Tsukimura K, Nakazawa H, Endo T, Fukunaga O
 
Physics and Chemistry of Minerals 19 (1992) 203-212
Cation distribution in Pentlandites (Fe,Ni)9S8: dependence of pressure and
temperature and kinetics of the cation exchange reaction
Sample: Natural, Fe/(Fe+Ni) = .470, T = 423 K, P = 0 GPa
Note: structure was not refined in this study
_database_code_amcsd 0007717
10.046 10.046 10.046 90 90 90 Fm3m
atom    x    y    z  occ
Fe1    .5   .5   .5 .687
Ni1    .5   .5   .5 .313
Fe2  .125 .125 .125 .443
Ni2  .125 .125 .125 .557
S1    .25  .25  .25
S2    .25    0    0
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Pentlandite
Download hom/pentlandite.pdf
Tsukimura K, Nakazawa H, Endo T, Fukunaga O
 
Physics and Chemistry of Minerals 19 (1992) 203-212
Cation distribution in Pentlandites (Fe,Ni)9S8: dependence of pressure and
temperature and kinetics of the cation exchange reaction
Sample: Natural, Fe/(Fe+Ni) = .470, T = 423 K, P = 0 GPa
Note: structure was not refined in this study
_database_code_amcsd 0007718
10.043 10.043 10.043 90 90 90 Fm3m
atom    x    y    z  occ
Fe1    .5   .5   .5 .707
Ni1    .5   .5   .5 .293
Fe2  .125 .125 .125 .440
Ni2  .125 .125 .125 .560
S1    .25  .25  .25
S2    .25    0    0
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Pentlandite
Download hom/pentlandite.pdf
Tsukimura K, Nakazawa H, Endo T, Fukunaga O
 
Physics and Chemistry of Minerals 19 (1992) 203-212
Cation distribution in Pentlandites (Fe,Ni)9S8: dependence of pressure and
temperature and kinetics of the cation exchange reaction
Sample: Natural, Fe/(Fe+Ni) = .470, T = 423 K, P = 0 GPa
Note: structure was not refined in this study
_database_code_amcsd 0007719
10.071 10.071 10.071 90 90 90 Fm3m
atom    x    y    z  occ
Fe1    .5   .5   .5 .519
Ni1    .5   .5   .5 .481
Fe2  .125 .125 .125 .464
Ni2  .125 .125 .125 .536
S1    .25  .25  .25
S2    .25    0    0
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Pentlandite
Download hom/pentlandite.pdf
Tsukimura K, Nakazawa H, Endo T, Fukunaga O
 
Physics and Chemistry of Minerals 19 (1992) 203-212
Cation distribution in Pentlandites (Fe,Ni)9S8: dependence of pressure and
temperature and kinetics of the cation exchange reaction
Sample: Natural, Fe/(Fe+Ni) = .470, T = 423 K, P = 0 GPa
Note: structure was not refined in this study
_database_code_amcsd 0007720
10.095 10.095 10.095 90 90 90 Fm3m
atom    x    y    z  occ
Fe1    .5   .5   .5 .358
Ni1    .5   .5   .5 .642
Fe2  .125 .125 .125 .484
Ni2  .125 .125 .125 .516
S1    .25  .25  .25
S2    .25    0    0
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Pentlandite
Download hom/pentlandite.pdf
Tsukimura K, Nakazawa H, Endo T, Fukunaga O
 
Physics and Chemistry of Minerals 19 (1992) 203-212
Cation distribution in Pentlandites (Fe,Ni)9S8: dependence of pressure and
temperature and kinetics of the cation exchange reaction
Sample: Natural, Fe/(Fe+Ni) = .470, T = 423 K, P = 0 GPa
Note: structure was not refined in this study
_database_code_amcsd 0007721
10.095 10.095 10.095 90 90 90 Fm3m
atom    x    y    z  occ
Fe1    .5   .5   .5 .358
Ni1    .5   .5   .5 .642
Fe2  .125 .125 .125 .484
Ni2  .125 .125 .125 .516
S1    .25  .25  .25
S2    .25    0    0
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Pentlandite
Download hom/pentlandite.pdf
Tsukimura K, Nakazawa H, Endo T, Fukunaga O
 
Physics and Chemistry of Minerals 19 (1992) 203-212
Cation distribution in Pentlandites (Fe,Ni)9S8: dependence of pressure and
temperature and kinetics of the cation exchange reaction
Sample: Naturala, Fe/(Fe+Ni) = .470, T = 293 K, P = 1 GPa
Note: structure was not refined in this study
_database_code_amcsd 0007722
10.044 10.044 10.044 90 90 90 Fm3m
atom    x    y    z  occ
Fe1    .5   .5   .5 .700
Ni1    .5   .5   .5 .300
Fe2  .125 .125 .125 .441
Ni2  .125 .125 .125 .559
S1    .25  .25  .25
S2    .25    0    0
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Pentlandite
Download hom/pentlandite.pdf
Tsukimura K, Nakazawa H, Endo T, Fukunaga O
 
Physics and Chemistry of Minerals 19 (1992) 203-212
Cation distribution in Pentlandites (Fe,Ni)9S8: dependence of pressure and
temperature and kinetics of the cation exchange reaction
Sample: Naturala, Fe/(Fe+Ni) = .470, T = 473 K, P = 0 GPa
Note: structure was not refined in this study
_database_code_amcsd 0007723
10.105 10.105 10.105 90 90 90 Fm3m
atom    x    y    z  occ
Fe1    .5   .5   .5 .290
Ni1    .5   .5   .5 .710
Fe2  .125 .125 .125 .493
Ni2  .125 .125 .125 .507
S1    .25  .25  .25
S2    .25    0    0
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Pentlandite
Download hom/pentlandite.pdf
Tsukimura K, Nakazawa H, Endo T, Fukunaga O
 
Physics and Chemistry of Minerals 19 (1992) 203-212
Cation distribution in Pentlandites (Fe,Ni)9S8: dependence of pressure and
temperature and kinetics of the cation exchange reaction
Sample: Naturalb, Fe/(Fe+Ni) = .491, T = 293 K, P = 0 GPa
Note: structure was not refined in this study
_database_code_amcsd 0007724
10.051 10.051 10.051 90 90 90 Fm3m
atom    x    y    z  occ
Fe1    .5   .5   .5 .723
Ni1    .5   .5   .5 .277
Fe2  .125 .125 .125 .462
Ni2  .125 .125 .125 .538
S1    .25  .25  .25
S2    .25    0    0
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Pentlandite
Download hom/pentlandite.pdf
Tsukimura K, Nakazawa H, Endo T, Fukunaga O
 
Physics and Chemistry of Minerals 19 (1992) 203-212
Cation distribution in Pentlandites (Fe,Ni)9S8: dependence of pressure and
temperature and kinetics of the cation exchange reaction
Sample: Naturalb, Fe/(Fe+Ni) = .491, T = 533 K, P = 0 GPa
Note: structure was not refined in this study
_database_code_amcsd 0007725
10.109 10.109 10.109 90 90 90 Fm3m
atom    x    y    z  occ
Fe1    .5   .5   .5 .333
Ni1    .5   .5   .5 .667
Fe2  .125 .125 .125 .511
Ni2  .125 .125 .125 .489
S1    .25  .25  .25
S2    .25    0    0
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Pentlandite
Download hom/pentlandite.pdf
Alsen N
 
Geologiska Foreningens i Stockholm Forhandlingar 47 (1925) 19-73
Roentgenographische Untersuchungen der Kristallstrukturen von
Magnetkies, Breithauptit, Pentlandit, Millerit und verwandten
Verbindungen
_cod_database_code 1011181
_database_code_amcsd 0018056
10.04 10.04 10.04 90 90 90 Fm3m
atom    x    y    z occ
Fe1   .25  .25  .25  .5
Fe2   .25    0    0  .5
Ni1   .25  .25  .25  .5
Ni2   .25    0    0  .5
S1   .125 .125 .125
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Pentlandite
Download hom/pentlandite.pdf
Lindqvist M, Lindqvist D, Westgren A
 
Svensk Kemisk Tidskrift 48 (1936) 156-160
The crystal structure of Co9 S8 and of pentlandite (Ni Fe)9 S8
_cod_database_code 1011207
_database_code_amcsd 0018077
10.09 10.09 10.09 90 90 90 Fm3m
atom    x    y    z occ
Fe1  .125 .125 .125  .5
Ni1  .125 .125 .125  .5
Fe2    .5   .5   .5  .5
Ni2    .5   .5   .5  .5
S1    .25  .25  .25
S2    .25    0    0
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Pentlandite
Download hom/pentlandite.pdf
Lindqvist M, Lindqvist D, Westgren A
 
Svensk Kemisk Tidskrift 48 (1936) 156-160
The crystal structure of Co9 S8 and of pentlandite (Ni Fe)9 S8
_cod_database_code 1011208
_database_code_amcsd 0018078
9.91 9.91 9.91 90 90 90 Fm3m
atom    x    y    z  occ
Fe1  .125 .125 .125 .667
Ni1  .125 .125 .125 .333
Fe2    .5   .5   .5 .667
Ni2    .5   .5   .5 .333
S1    .25  .25  .25
S2    .25    0    0
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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Total number of retrieved datasets: 45
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