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arxiv: 0805.2723 · v1 · submitted 2008-05-18 · ⚛️ physics.atom-ph · physics.chem-ph· physics.comp-ph

Efficient 6j symbol evaluations for atomic calculations

classification ⚛️ physics.atom-ph physics.chem-phphysics.comp-ph
keywords calculationsschemesymbolatomicefficientadditionanotherappropriate
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We have developed an efficient tabulation scheme to evaluate $6j$ symbol for atomic calculations. The scheme is appropriate for coupled-cluster based calculations. In particular, for perturbed coupled-clusters calculations, which has another perturbation in addition to the residual Coulomb interaction. The scheme relies on the symmetry of the $6j$ symbol and the triangular conditions.

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