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CI-MBPT: A package of programs for relativistic atomic calculations based on a method combining configuration interaction and many-body perturbation theory

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Mendeley Data2024-06-25 更新2024-06-26 收录
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Abstract This package of programs allows us to carry out relativistic calculations for many-electron atoms and ions. One can find energy levels and a number of atomic properties: g -factors, magnetic-dipole and electric-quadrupole hyperfine structure constants, electric- and magnetic-multipole transition amplitudes, and matrix elements of the parity nonconserving interactions. Method of calculation is based on a combination of conventional configuration interaction (CI) method and many-body perturbati... Title of program: CI-MBPT Catalogue Id: AEWV_v1_0 Nature of problem Prediction of atomic or ionic energy levels and different observables in the framework of relativistic approach. Versions of this program held in the CPC repository in Mendeley Data AEWV_v1_0; CI-MBPT; 10.1016/j.cpc.2015.05.007 This program has been imported from the CPC Program Library held at Queen's University Belfast (1969-2018)
创建时间:
2024-01-23
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