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Coccinite |
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Schwarzenbach D, Birkedal H, Hostettler M, Fischer P |
 |
Acta Crystallographica B63 (2007) 828-835 |
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Neutron diffraction investigation of the temperature dependence of |
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crystal structure and thermal motions of red HgI2 |
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Note: T = 10 K, powder neutron data |
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Locality: synthetic, Fluka 83379 |
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_database_code_amcsd 0019547 |
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4.358 4.358 12.300 90 90 90 *P4_2/nmc |
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.25 -.25 .25 |
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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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Hg .25 .75 .25 .0013 .0013 .0013 .0011 0 0 0 |
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I .25 .25 .3915 .0011 .0024 .0001 .0008 0 0 0 |
|
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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) |
  |
|
Coccinite |
|
Schwarzenbach D, Birkedal H, Hostettler M, Fischer P |
 |
Acta Crystallographica B63 (2007) 828-835 |
|
Neutron diffraction investigation of the temperature dependence of |
|
crystal structure and thermal motions of red HgI2 |
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Note: T = 30 K, powder neutron data |
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Locality: synthetic, Fluka 83379 |
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_database_code_amcsd 0019548 |
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4.358 4.358 12.306 90 90 90 *P4_2/nmc |
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.25 -.25 .25 |
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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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Hg .25 .75 .25 .0035 .0036 .0036 .0032 0 0 0 |
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I .25 .25 .3914 .0027 .0048 .0009 .0025 0 0 0 |
|
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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) |
  |
|
Coccinite |
|
Schwarzenbach D, Birkedal H, Hostettler M, Fischer P |
 |
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 |
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Locality: synthetic, Fluka 83379 |
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_database_code_amcsd 0019549 |
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4.359 4.359 12.319 90 90 90 *P4_2/nmc |
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.25 -.25 .25 |
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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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Hg .25 .75 .25 .0071 .0071 .0071 .0071 0 0 0 |
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I .25 .25 .3912 .0057 .0088 .0040 .0043 0 0 0 |
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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) |
  |
|
Coccinite |
|
Schwarzenbach D, Birkedal H, Hostettler M, Fischer P |
 |
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 |
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_database_code_amcsd 0019550 |
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4.360 4.360 12.337 90 90 90 *P4_2/nmc |
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.25 -.25 .25 |
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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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Hg .25 .75 .25 .0122 .0124 .0124 .0120 0 0 0 |
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I .25 .25 .3909 .0103 .0157 .0078 .0074 0 0 0 |
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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) |
  |
|
Coccinite |
|
Schwarzenbach D, Birkedal H, Hostettler M, Fischer P |
 |
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 |
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Locality: synthetic, Fluka 83379 |
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_database_code_amcsd 0019551 |
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4.365 4.365 12.389 90 90 90 *P4_2/nmc |
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.25 -.25 .25 |
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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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Hg .25 .75 .25 .0272 .0276 .0276 .0264 0 0 0 |
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I .25 .25 .3904 .022 .034 .015 .016 0 0 0 |
|
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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) |
  |
|
Coccinite |
|
Schwarzenbach D, Birkedal H, Hostettler M, Fischer P |
 |
Acta Crystallographica B63 (2007) 828-835 |
|
Neutron diffraction investigation of the temperature dependence of |
|
crystal structure and thermal motions of red HgI2 |
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Note: T = 293 K, powder neutron data |
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Locality: synthetic, Fluka 83379 |
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_database_code_amcsd 0019552 |
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4.370 4.370 12.437 90 90 90 *P4_2/nmc |
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.25 -.25 .25 |
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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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Hg .25 .75 .25 .043 .042 .042 .042 0 0 0 |
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I .25 .25 .3898 .033 .052 .022 .026 0 0 0 |
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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) |
  |
|
Coccinite |
|
Schwarzenbach D, Birkedal H, Hostettler M, Fischer P |
 |
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 |
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4.3675 4.3675 12.470 90 90 90 *P4_2/nmc |
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.25 -.25 .25 |
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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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Hg .25 .75 .25 .053 .050 .050 .059 0 0 0 |
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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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Coccinite |
|
Schwarzenbach D |
 |
Zeitschrift fur Kristallographie 128 (1969) 97-114 |
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The crystal structure and one-dimensional disorder of the orange |
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modification of HgI2 |
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Locality: synthetic |
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Note: this is a polymorph of coccinite |
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_database_code_amcsd 0010671 |
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8.776 8.776 24.732 90 90 90 I4_1/amd |
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atom x y z |
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Hg 0 .25 .3125 |
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I1 0 0 .125 |
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I2 0 0 .375 |
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I3 .25 .25 0 |
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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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Coccinite |
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Bijvoet J, Claassen A, Karssen A |
  |
Proceedings of the Koninklijke Nederlandse Academie van Wetenschappen 29 (1926) 529-546 |
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The crystal structure of red mercuric iodide |
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_cod_database_code 1010063 |
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_database_code_amcsd 0016999 |
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4.357 4.357 12.36 90 90 90 P4_2/nmc |
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atom x y z |
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Hg1 0 0 0 |
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I1 0 .5 .139 |
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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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