COMPUTATIONAL STRATEGIES FOR THE OPTIMIZATION OF EQUILIBRIUM GEOMETRIES AND TRANSITION-STATE STRUCTURES AT THE SEMIEMPIRICAL LEVEL

被引:24
作者
CUMMINS, PL
GREADY, JE
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D O I
10.1002/jcc.540100712
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O6 [化学];
学科分类号
0703 ;
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页码:939 / 950
页数:12
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