## Abstract By making the atomic effective charge selfβconsistent with the molecular charge density, it is shown that the PPP method can accurately predict the ionization potential and electron affinity computed as an energy difference of separately minimized ground and ionized states. The calculat
β¦ LIBER β¦
The differential correlation energy method for the calculation of electron affinities, ionization potentials, and vertical spectra
β Scribed by Arnold C. Wahl; Edward S. Sachs; John H. Detrich
- Publisher
- John Wiley and Sons
- Year
- 2009
- Tongue
- English
- Weight
- 62 KB
- Volume
- 18
- Category
- Article
- ISSN
- 0020-7608
No coin nor oath required. For personal study only.
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