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Bayerite |
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Rothbauer R, Zigan F, O'Daniel H |
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Zeitschrift fur Kristallographie 125 (1967) 317-331 |
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Verfeinerung der struktur des bayerits, Al(OH)3 |
|
_database_code_amcsd 0010649 |
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5.062 8.671 4.713 90 90.27 90 P2_1/a |
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atom x y z Biso |
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Al .527 .167 -.015 2.2 |
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O1 .365 -.011 .215 2.4 |
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O2 .204 .176 .777 3.0 |
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O3 .344 .308 .229 .8 |
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H1 .32 .52 .77 |
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H2 .79 .40 .73 |
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H3 .32 .31 .39 |
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| |
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Malachite |
|
Zigan F, Joswig W, Schuster H U, Mason S A |
| |
Zeitschrift fur Kristallographie 145 (1977) 412-426 |
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Verfeinerung der Struktur von Malachit, Cu2(OH)2CO3, durch Neutronenbeugung |
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_database_code_amcsd 0010795 |
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9.502 11.974 3.240 90 98.75 90 P2_1/a |
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atom x y z U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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Cu1 .49814 .28793 .8925 .0065 .0068 .0105 .0013 -.0019 -.0005 |
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Cu2 .23242 .39331 .3880 .0068 .0066 .0094 .0005 -.0023 -.0012 |
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O1 .13150 .13646 .3417 .0073 .0091 .0168 -.0008 -.0031 .0021 |
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O2 .33325 .23591 .4500 .0081 .0065 .0145 -.0013 -.0021 .0005 |
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O3 .33412 .05622 .6308 .0088 .0071 .0176 -.0005 -.0035 .0017 |
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O4 .09403 .35155 .9191 .0070 .0066 .0122 -.0013 -.0025 -.0007 |
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O5 .37725 .41615 .8598 .0077 .0064 .0137 .0008 -.0029 -.0005 |
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C1 .26622 .14075 .4727 .0062 .0060 .0089 -.0009 -.0012 -.0003 |
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H1 .0167 .4048 .8444 .0198 .0196 .0305 .0057 -.0014 .0013 |
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H2 .4105 .4918 .8296 .0288 .0140 .0388 -.0059 -.0016 -.0001 |
|
|
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|
| |
|
Brucite |
|
Zigan F, Rothbauer R |
| |
Neues Jahrbuch fur Mineralogie, Monatshefte 1967 (1967) 137-143 |
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Neutronenbeugungsmessungen am Brucit |
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_cod_database_code 1000054 |
|
_database_code_amcsd 0014731 |
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3.142 3.142 4.766 90 90 120 P-3m1 |
|
atom x y z |
|
Mg 0 0 0 |
|
O 1/3 2/3 .2216 |
|
H 1/3 2/3 .4303 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
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View JMOL 3-D Structure
|
| |
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