Nuclear structure calculations with coupled cluster methods from quantum chemistry

D. J. Dean, J. R. Gour, G. Hagen, M. Hjorth-Jensen, K. Kowalski, T. Papenbrock, P. Piecuch, M. Włoch

Research output: Contribution to journalArticlepeer-review

17 Scopus citations

Abstract

We present several coupled-cluster calculations of ground and excited states of 4He and 16O employing methods from quantum chemistry. A comparison of coupled cluster results with the results of exact diagonalization of the hamiltonian in the same model space and other truncated shell-model calculations shows that the quantum chemistry inspired coupled cluster approximations provide an excellent description of ground and excited states of nuclei, with much less computational effort than traditional large-scale shell-model approaches. Unless truncations are made, for nuclei like 16O, full-fledged shell-model calculations with four or more major shells are not possible. However, these and even larger systems can be studied with the coupled cluster methods due to the polynomial rather than factorial scaling inherent in standard shell-model studies. This makes the coupled cluster approaches, developed in quantum chemistry, viable methods for describing weakly bound systems of interest for future nuclear facilities.

Original languageEnglish
Pages (from-to)299-308
Number of pages10
JournalNuclear Physics A
Volume752
Issue number1-4 SPEC. ISS.
DOIs
StatePublished - Apr 18 2005
Externally publishedYes

Funding

Supported by the U.S. Department of Energy under Contract Nos. DE-FG02-96ER40963 (University of Tennessee), DE-AC05-00OR22725 with UT-Battelle, LLC (Oak Ridge National Laboratory), and DE-FG02-01ER15228 (Michigan State University), the National Science Foundation (Grant No. CHE-0309517; Michigan State University), the Research Council of Norway, and the Alfred P. Sloan Foundation (P.P.).

FundersFunder number
National Science FoundationCHE-0309517
U.S. Department of EnergyDE-FG02-96ER40963
Directorate for Mathematical and Physical Sciences0309517
Alfred P. Sloan Foundation
Oak Ridge National LaboratoryDE-FG02-01ER15228
University of TennesseeDE-AC05-00OR22725
Michigan State University
Norges Forskningsråd

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