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Omphacite |
 |
Pavese A, Bocchio R, Ivaldi G |
 |
Mineralogical Magazine 64 (2000) 983-993 |
|
In situ high temperature single crystal X-ray diffraction study of a natural omphacite |
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Locality: Gorduno, Lepontine Alps, Switzerland |
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Note: structure at room temperature (T=298K) |
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_database_code_amcsd 0014547 |
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9.569 8.759 5.256 90 106.96 90 P2/n |
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atom x y z occ Uiso |
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CaM2 .75 .0523 .25 .291 .0094 |
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NaM2 .75 .0523 .25 .709 .0094 |
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CaM21 .75 .4505 .75 .709 .0105 |
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NaM21 .75 .4505 .75 .291 .0105 |
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MgM1 .75 .65926 .25 .46 .0069 |
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AlM1 .75 .65926 .25 .48 .0069 |
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FeM1 .75 .65926 .25 .06 .0069 |
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MgM11 .75 .84740 .75 .46 .0033 |
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AlM11 .75 .84740 .75 .48 .0033 |
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FeM11 .75 .84740 .75 .06 .0033 |
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SiT1 .03948 .84770 .22674 .985 .0044 |
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AlT1 .03948 .84770 .22674 .015 .0044 |
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SiT2 .03722 .66247 .73047 .985 .0043 |
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AlT2 .03722 .66247 .73047 .015 .0043 |
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O11 .8630 .8393 .1201 .0067 |
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O12 .8610 .6780 .6482 .0067 |
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O21 .1149 .0102 .3093 .0079 |
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O22 .1061 .4975 .8050 .0090 |
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O31 .1066 .7665 .0039 .0067 |
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O32 .0980 .7403 .4977 .0071 |
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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
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| |
|
Omphacite |
|
Pavese A, Bocchio R, Ivaldi G |
|
Mineralogical Magazine 64 (2000) 983-993 |
|
In situ high temperature single crystal X-ray diffraction study of a natural omphacite |
|
Locality: Gorduno, Lepontine Alps, Switzerland |
|
Note: structure at high temperature (T=1073K) |
|
_database_code_amcsd 0014548 |
|
9.627 8.846 5.282 90 107.06 90 P2/n |
|
atom x y z occ Uiso |
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CaM2 .75 .0519 .25 .303 .0310 |
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NaM2 .75 .0519 .25 .697 .0310 |
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CaM21 .75 .4511 .75 .697 .0340 |
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NaM21 .75 .4511 .75 .303 .0340 |
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MgM1 .75 .6578 .25 .46 .0200 |
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AlM1 .75 .6578 .25 .48 .0200 |
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FeM1 .75 .6578 .25 .06 .0200 |
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MgM11 .75 .8493 .75 .46 .0138 |
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AlM11 .75 .8493 .75 .48 .0138 |
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FeM11 .75 .8493 .75 .06 .0138 |
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SiT1 .03918 .84722 .2258 .985 .0128 |
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AlT1 .03918 .84722 .2258 .015 .0128 |
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SiT2 .03689 .66333 .7295 .985 .0130 |
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AlT2 .03689 .66333 .7295 .015 .0130 |
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O11 .8635 .8384 .1196 .0182 |
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O12 .8615 .6789 .6476 .0184 |
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O21 .1145 .0082 .3058 .0231 |
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O22 .1057 .5002 .8011 .0264 |
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O31 .1053 .7649 .0046 .0203 |
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O32 .0965 .7428 .4988 .0206 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Omphacite |
|
Pavese A, Bocchio R, Ivaldi G |
|
Mineralogical Magazine 64 (2000) 983-993 |
|
In situ high temperature single crystal X-ray diffraction study of a natural omphacite |
|
Locality: Gorduno, Lepontine Alps, Switzerland |
|
Note: structure at room temperature (T=298K), after being heated to 1073K |
|
_database_code_amcsd 0014549 |
|
9.563 8.776 5.254 90 106.90 90 P2/n |
|
atom x y z occ Uiso |
|
CaM2 .75 .0522 .25 .310 .0103 |
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NaM2 .75 .0522 .25 .690 .0103 |
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CaM21 .75 .4501 .75 .690 .0114 |
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NaM21 .75 .4501 .75 .310 .0114 |
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MgM1 .75 .65870 .25 .46 .0069 |
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AlM1 .75 .65870 .25 .48 .0069 |
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FeM1 .75 .65870 .25 .06 .0069 |
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MgM11 .75 .84716 .75 .46 .0039 |
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AlM11 .75 .84716 .75 .48 .0039 |
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FeM11 .75 .84716 .75 .06 .0039 |
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SiT1 .03924 .84712 .2269 .985 .0048 |
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AlT1 .03924 .84712 .2269 .015 .0048 |
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SiT2 .03737 .66177 .7302 .985 .0047 |
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AlT2 .03737 .66177 .7302 .015 .0047 |
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O11 .8628 .8379 .1215 .0079 |
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O12 .8610 .6770 .6465 .0079 |
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O21 .1142 .0097 .3086 .0086 |
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O22 .1064 .4970 .8049 .0095 |
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O31 .1060 .7660 .0039 .0073 |
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O32 .0984 .7399 .4976 .0074 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
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