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Phase-A |
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Kagi H, Parise J B, Cho H, Rossman G R, Loveday J S |
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Physics and Chemistry of Minerals 27 (2000) 225-233 |
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Hydrogen bonding interactions in phase A [Mg7Si2O8(OH)6] |
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at ambient and high pressure |
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Sample: P = 0 GPa |
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_database_code_amcsd 0008404 |
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7.8563 7.8563 9.5642 90 90 120 P6_3 |
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atom x y z Biso |
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Mg1 .3722 .4547 .3857 .78 |
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Mg2 .2252 .2438 .1127 .78 |
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Mg3 1/3 2/3 .1029 .78 |
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Si1 2/3 1/3 .1741 .67 |
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Si2 0 0 .4018 .67 |
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O1 .2001 .0274 -.024 .74 |
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O2 .4766 .0988 .4844 .74 |
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O3 .4538 .2947 .2320 .74 |
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O4 .1704 .4367 .2398 .74 |
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O5 2/3 1/3 0 .74 |
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O6 0 0 .2323 .74 |
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HD1 .455 .161 .405 2.6 |
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HD2 .038 .361 .240 2.6 |
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View JMOL 3-D Structure (permalink)
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