Efficacy of the SU(3) scheme for ab initio large-scale calculations beyond the lightest nuclei

We report on the computational characteristics of ab initio nuclear structure calculations in a symmetry-adapted no-core shell model (SA-NCSM) framework. We examine the computational complexity of the current implementation of the SA-NCSM approach, dubbed LSU3shell, by analyzing ab initio results fo...

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Veröffentlicht in:Computer physics communications 2016-10, Vol.207 (C), p.202-210
Hauptverfasser: Dytrych, T., Maris, P., Launey, K.D., Draayer, J.P., Vary, J.P., Langr, D., Saule, E., Caprio, M.A., Catalyurek, U., Sosonkina, M.
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Sprache:eng
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Zusammenfassung:We report on the computational characteristics of ab initio nuclear structure calculations in a symmetry-adapted no-core shell model (SA-NCSM) framework. We examine the computational complexity of the current implementation of the SA-NCSM approach, dubbed LSU3shell, by analyzing ab initio results for 6Li and 12C in large harmonic oscillator model spaces and SU3-selected subspaces. We demonstrate LSU3shell’s strong-scaling properties achieved with highly-parallel methods for computing the many-body matrix elements. Results compare favorably with complete model space calculations and significant memory savings are achieved in physically important applications. In particular, a well-chosen symmetry-adapted basis affords memory savings in calculations of states with a fixed total angular momentum in large model spaces while exactly preserving translational invariance.
ISSN:0010-4655
1879-2944
DOI:10.1016/j.cpc.2016.06.006