✦ LIBER ✦

The extended Koopmans’ theorem: Vertical ionization potentials from natural orbital functional theory

✍ Scribed by Piris, Mario; Matxain, Jon M.; Lopez, Xabier; Ugalde, Jesus M.

Book ID: 111654891
Publisher: American Institute of Physics
Year: 2012
Tongue: English
Weight: 368 KB
Volume: 136
Category: Article
ISSN: 0021-9606
DOI: 10.1063/1.4709769

No coin nor oath required. For personal study only.

📜 SIMILAR VOLUMES

Exact ionization potentials from wavefun

Exact ionization potentials from wavefunction asymptotics: The extended Koopmans’ theorem, revisited

✍ Vanfleteren, Diederik; Van Neck, Dimitri; Ayers, Paul W.; Morrison, Robert C.; B 📂 Article 📅 2009 🏛 American Institute of Physics 🌐 English ⚖ 566 KB

Ionization potentials and electron affin

Ionization potentials and electron affinities from the extended Koopmans’ theorem applied to energy-derivative density matrices: The EKTMPn and EKTQCISD methods

✍ Cioslowski, Jerzy; Piskorz, Pawel; Liu, Guanghua 📂 Article 📅 1997 🏛 American Institute of Physics 🌐 English ⚖ 373 KB