A variant of the brillouin-wigner perturbation theory with epstein-nesbet partitioning

Sangyoub Lee, Cheol Ho Choi, Eunji Kim, Young Kyun Choi

Research output: Contribution to journalArticlepeer-review

1 Scopus citations

Abstract

We present an elementary pedagogical derivation of the Brillouin-Wigner and the Rayleigh-Schrödinger perturbation theories with Epstein-Nesbet partitioning. A variant of the Brillouin-Wigner perturbation theory is also introduced, which can be easily extended to the quasi-degenerate case. A main advantage of the new theory is that the computing time required for obtaining the successive higher-order results is minimal after the third-order calculation. We illustrate the accuracy of the new perturbation theory for some simple model systems like the perturbed harmonic oscillator and the particle in a box.

Original languageEnglish
Pages (from-to)3279-3283
Number of pages5
JournalBulletin of the Korean Chemical Society
Volume34
Issue number11
DOIs
StatePublished - 20 Nov 2013

Keywords

  • Perturbation theory

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