Computational analysis of the potential energy surfaces of glycerol in the gas and condensed phases.

被引:0
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作者
Callam, CS [1 ]
Singer, SJ [1 ]
Lowary, TL [1 ]
Hadad, CM [1 ]
机构
[1] Ohio State Univ, Dept Chem, Columbus, OH 43210 USA
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D O I
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中图分类号
O6 [化学];
学科分类号
0703 ;
摘要
61-CARB
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页码:U171 / U171
页数:1
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