Quantum Chemistry Calculations for Molecular Ground State Energy and Chemical Reactions
博士 === 國立臺灣大學 === 化學學系 === 82 === The thesis contains two topics, in the first part, a new calculational strategy was developed for molecular electronic system; and UMP4/6-31+G*//UHF/6-31+G* level calculations for reductive cleavage reactions were perform...
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| Format: | Others |
| Language: | zh-TW |
| Published: |
1994
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| Online Access: | http://ndltd.ncl.edu.tw/handle/83041225861563722937 |