Perspectives of APSG‐based multireference perturbation theories | Zendy

Jeszenszki Péter | Zendy; Nagy Péter R. | Zendy; Zoboki Tamás | Zendy; Szabados Ágnes | Zendy; Surján Péter R. | Zendy

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Perspectives of APSG‐based multireference perturbation theories

Author(s) -

Jeszenszki Péter,

Nagy Péter R.,

Zoboki Tamás,

Szabados Ágnes,

Surján Péter R.

Publication year - 2014

Publication title -

international journal of quantum chemistry

Language(s) - English

Resource type - Journals

SCImago Journal Rank - 0.484

H-Index - 105

eISSN - 1097-461X

pISSN - 0020-7608

DOI - 10.1002/qua.24634

Subject(s) - multireference configuration interaction , perturbation (astronomy) , perturbation theory (quantum mechanics) , wave function , computational chemistry , field (mathematics) , physics , chemistry , theoretical physics , quantum mechanics , density functional theory , mathematics , basis set , pure mathematics

Applicability of antisymmetrized product of strongly orthogonal geminals type wave functions, serving reference states for multireference many‐body perturbation theories, is discussed. Emerging recent interest in this field indicates a promising future of this approach. © 2014 Wiley Periodicals, Inc.

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