Ionization Potential, Electron Affinity, Electronegativity, Hardness, and Electron Excitation Energy: Molecular Properties from Density Functional Theory Orbital Energies
- 期刊名称The Journal of Physical Chemistry A
- 作者Zhan, Chang-Guo; Nichols, Jeffrey A.; Dixon, David A.
- 卷第107卷
- 期第20期
- 印刷ISSN1089-5639
- 电子ISSN1520-5215
- 文件大小184.88KB
- 发表时间2003-05
- DOI10.1021/jp0225774
- 页码4184-4195
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