Symmetry projection to coupled-cluster singles plus doubles wave function through the Monte Carlo method

A method for calculating the symmetry-projected energy of coupled-cluster singles plus doubles (CCSD) wave function through the Monte Carlo method is proposed. We present benchmark calculations in considering the three-level Lipkin model which is a simple and minimal model with two phases: spherical...

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Veröffentlicht in:Phys.Rev.C 2021-09, Vol.104 (3), Article 031305
Hauptverfasser: Mizusaki, Takahiro, Schuck, Peter
Format: Artikel
Sprache:eng
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Zusammenfassung:A method for calculating the symmetry-projected energy of coupled-cluster singles plus doubles (CCSD) wave function through the Monte Carlo method is proposed. We present benchmark calculations in considering the three-level Lipkin model which is a simple and minimal model with two phases: spherical and deformed. It is demonstrated that this method gives good ground-state energy and low-lying spectra.
ISSN:2469-9985
2469-9993
DOI:10.1103/PhysRevC.104.L031305