Accurate ab Initio Intermolecular Potentials for Ar-CF4 and CF4-CF4
碩士 === 國立清華大學 === 化學工程學系 === 98 === The purpose of this research is to investigate the accuracy of the intermolecular potential energies, which were calculated with different quantum chemistry methods and basis sets. The quantum chemistry methods that were used in this research are MP2 and CCSD(T),...
| Main Authors: | , |
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| Other Authors: | |
| Format: | Others |
| Language: | zh-TW |
| Published: |
2010
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| Online Access: | http://ndltd.ncl.edu.tw/handle/21410185847243787790 |