Studies Intercalation Effects of Alkaline Metal Ions on Carbon Nanotubes by ab initio Calculations
碩士 === 國立成功大學 === 化學系碩博士班 === 92 === Ab initio calculations at Hartree-Fock (HF) level have been performed on benzene, polycyclic aromatic hydrocarbons (PAH), C60 and carbon nanotubes (CNT) intercalated by alkaline metal ions. HF energies of the M+--benzene systems calculated at various distances...
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| Format: | Others |
| Language: | zh-TW |
| Published: |
2004
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| Online Access: | http://ndltd.ncl.edu.tw/handle/jdd627 |