DFT/PP Computational Studies of TM Clusters
博士 === 國立中正大學 === 化學研究所 === 92 === This thesis contains three parts of my work : the magnetic and energetic properties of iron clusters Fen, n=1 ~ 4, an analysis of density functional theory ( DFT ) results for the geometry optimization of small pure-silver and silver-oxide clusters using relativist...
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| Format: | Others |
| Language: | en_US |
| Published: |
2003
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| Online Access: | http://ndltd.ncl.edu.tw/handle/72524536892525958852 |