The Fock Matrix Analysis for Atomic Orbitals in Molecular Orbitals. A New Look on the Covalent Bond in H2+ and H2
碩士 === 國立成功大學 === 化學系碩博士班 === 90 === The Fock operator can take all interaction within the molecular environment into account, therefore the character of the molecular orbitals can be better accounted for in terms of molecular adapted atomic orbitals and the Fock matrix expanded in these atomic orb...
| Main Authors: | , |
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| Other Authors: | |
| Format: | Others |
| Language: | zh-TW |
| Published: |
2002
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| Online Access: | http://ndltd.ncl.edu.tw/handle/40217133892107537843 |