Determination of the lowest energy point
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Nobuaki Koga; Keiji Morokuma
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Article
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1985
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Elsevier Science
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English
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A method is presenkd 10 sarch for the energy minrmum crossing poim bewren IHCI po~mudl surracrs \\lxh the ad or Ihe energy gmdiem and rhe optimization method with n conslraint The melhod hns been apphed LO LU'O lou-lying wiplel excited shades or chlorobenzene with the nb iniuo UHF warcfunclion.