American Mineralogist Crystal Structure Database

7 matching records for this search.

Coccinite
 
Schwarzenbach D, Birkedal H, Hostettler M, Fischer P
Download http://scripts.iucr.org/cgi-bin/openurl?genre=article&issn=0108-7681&volume=63&spage=828
Acta Crystallographica B63 (2007) 828-835
Neutron diffraction investigation of the temperature dependence of
crystal structure and thermal motions of red HgI2
Note: T = 10 K, powder neutron data
Locality: synthetic, Fluka 83379
_database_code_amcsd 0019547
4.358 4.358 12.300 90 90 90 *P4_2/nmc
.25 -.25 .25
atom   x   y     z  Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Hg   .25 .75   .25 .0013  .0013  .0013  .0011      0      0      0
I    .25 .25 .3915 .0011  .0024  .0001  .0008      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)
 
Coccinite
 
Schwarzenbach D, Birkedal H, Hostettler M, Fischer P
Download http://scripts.iucr.org/cgi-bin/openurl?genre=article&issn=0108-7681&volume=63&spage=828
Acta Crystallographica B63 (2007) 828-835
Neutron diffraction investigation of the temperature dependence of
crystal structure and thermal motions of red HgI2
Note: T = 30 K, powder neutron data
Locality: synthetic, Fluka 83379
_database_code_amcsd 0019548
4.358 4.358 12.306 90 90 90 *P4_2/nmc
.25 -.25 .25
atom   x   y     z  Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Hg   .25 .75   .25 .0035  .0036  .0036  .0032      0      0      0
I    .25 .25 .3914 .0027  .0048  .0009  .0025      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)
 
Coccinite
 
Schwarzenbach D, Birkedal H, Hostettler M, Fischer P
Download http://scripts.iucr.org/cgi-bin/openurl?genre=article&issn=0108-7681&volume=63&spage=828
Acta Crystallographica B63 (2007) 828-835
Neutron diffraction investigation of the temperature dependence of
crystal structure and thermal motions of red HgI2
Note: T = 60 K, powder neutron data
Locality: synthetic, Fluka 83379
_database_code_amcsd 0019549
4.359 4.359 12.319 90 90 90 *P4_2/nmc
.25 -.25 .25
atom   x   y     z  Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Hg   .25 .75   .25 .0071  .0071  .0071  .0071      0      0      0
I    .25 .25 .3912 .0057  .0088  .0040  .0043      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)
 
Coccinite
 
Schwarzenbach D, Birkedal H, Hostettler M, Fischer P
Download http://scripts.iucr.org/cgi-bin/openurl?genre=article&issn=0108-7681&volume=63&spage=828
Acta Crystallographica B63 (2007) 828-835
Neutron diffraction investigation of the temperature dependence of
crystal structure and thermal motions of red HgI2
Note: T = 100 K, powder neutron data
Locality: synthetic, Fluka 83379
_database_code_amcsd 0019550
4.360 4.360 12.337 90 90 90 *P4_2/nmc
.25 -.25 .25
atom   x   y     z  Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Hg   .25 .75   .25 .0122  .0124  .0124  .0120      0      0      0
I    .25 .25 .3909 .0103  .0157  .0078  .0074      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)
 
Coccinite
 
Schwarzenbach D, Birkedal H, Hostettler M, Fischer P
Download http://scripts.iucr.org/cgi-bin/openurl?genre=article&issn=0108-7681&volume=63&spage=828
Acta Crystallographica B63 (2007) 828-835
Neutron diffraction investigation of the temperature dependence of
crystal structure and thermal motions of red HgI2
Note: T = 200 K, powder neutron data
Locality: synthetic, Fluka 83379
_database_code_amcsd 0019551
4.365 4.365 12.389 90 90 90 *P4_2/nmc
.25 -.25 .25
atom   x   y     z  Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Hg   .25 .75   .25 .0272  .0276  .0276  .0264      0      0      0
I    .25 .25 .3904  .022   .034   .015   .016      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)
 
Coccinite
 
Schwarzenbach D, Birkedal H, Hostettler M, Fischer P
Download http://scripts.iucr.org/cgi-bin/openurl?genre=article&issn=0108-7681&volume=63&spage=828
Acta Crystallographica B63 (2007) 828-835
Neutron diffraction investigation of the temperature dependence of
crystal structure and thermal motions of red HgI2
Note: T = 293 K, powder neutron data
Locality: synthetic, Fluka 83379
_database_code_amcsd 0019552
4.370 4.370 12.437 90 90 90 *P4_2/nmc
.25 -.25 .25
atom   x   y     z  Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Hg   .25 .75   .25  .043   .042   .042   .042      0      0      0
I    .25 .25 .3898  .033   .052   .022   .026      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)
 
Coccinite
 
Schwarzenbach D, Birkedal H, Hostettler M, Fischer P
Download http://scripts.iucr.org/cgi-bin/openurl?genre=article&issn=0108-7681&volume=63&spage=828
Acta Crystallographica B63 (2007) 828-835
Neutron diffraction investigation of the temperature dependence of
crystal structure and thermal motions of red HgI2
Note: T = 293 K, single crystal X-ray data
Locality: synthetic, Fluka 83379
_database_code_amcsd 0019553
4.3675 4.3675 12.470 90 90 90 *P4_2/nmc
.25 -.25 .25
atom   x   y     z  Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Hg   .25 .75   .25  .053   .050   .050   .059      0      0      0
I    .25 .25 .3890  .043   .057   .031   .042      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)
 
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Total number of retrieved datasets: 7
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