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Extension of coupled-cluster theory with a non-iterative treatment of connected triply excited clusters to three-body Hamiltonians

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abstract

We generalize the coupled-cluster (CC) approach with singles, doubles, and the non-iterative treatment of triples termed $\Lambda$CCSD(T) to Hamiltonians containing three-body interactions. The resulting method and the underlying CC approach with singles and doubles only (CCSD) are applied to the medium-mass closed-shell nuclei O16, O24, and Ca40. By comparing the results of CCSD and $\Lambda$CCSD(T) calculations with explicit treatment of three-nucleon interactions to those obtained using an approximate treatment in which they are included effectively via the zero-, one-, and two-body components of the Hamiltonian in normal-ordered form, we quantify the contributions of the residual three-body interactions neglected in the approximate treatment. We find these residual normal-ordered three-body contributions negligible for the $\Lambda$CCSD(T) method, although they can become significant in the lower-level CCSD approach, particularly when the nucleon-nucleon interactions are soft.

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nucl-th 1

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2024 1

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CONDITIONAL 1

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Improved structure of calcium isotopes from ab initio calculations

nucl-th · 2024-11-24 · conditional · novelty 6.0

IMSRG(3)-N7 calculations for calcium-44, -48, and -52 show that three-body flow corrections substantially lower the 48Ca 2+ energy, improving the description of the N=28 shell closure, while leaving the 52Ca charge-radius puzzle unresolved.

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  • Improved structure of calcium isotopes from ab initio calculations nucl-th · 2024-11-24 · conditional · none · ref 61 · internal anchor

    IMSRG(3)-N7 calculations for calcium-44, -48, and -52 show that three-body flow corrections substantially lower the 48Ca 2+ energy, improving the description of the N=28 shell closure, while leaving the 52Ca charge-radius puzzle unresolved.