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ArticleJ-GLOBAL ID:200902023186869879整理番号:90A0095581

Analytic second derivatives with model potentials at SCF and MP2 levels.

SCFおよびMP2水準のポテンシャル模型による解析的二次導関数

著者:JAYATILAKA D(University Chemical Lab., Cambridge, GBR)、AMOS R D(University Chemical Lab., Cambridge, GBR)、KOGA N(Inst. Molecular Science, Okazaki, JPN)
資料名:Chem Phys Lett 巻:163 号:2/3 ページ:151-156
発行年:1989年11月10日
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