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Calculation of the electron-nucleus scalar-pseudoscalar interaction constant WS for YbF and BaF molecules:: A perturbative approach

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PHYSICAL REVIEW A
卷 78, 期 1, 页码 -

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AMER PHYSICAL SOC
DOI: 10.1103/PhysRevA.78.012506

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The P,T-odd interaction constant, W-S, for the ground state of YbF and BaF molecules are calculated using the second-order many-body perturbation theory (MBPT) via Z-vector technique. The interaction constant W-S reported here agrees favorably well with other correlated calculations. We also address the convergence behavior of W-S with respect to the number of active orbitals used in the perturbative calculations.

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