most cited4-component relativistic Hamiltonian with effective QED potentials for molecular calculations

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physics.chem-ph2022★ 53 cited

4-component relativistic Hamiltonian with effective QED potentials for molecular calculations

Ayaki Sunaga, Maen Salman, Trond Saue

We report the implementation of effective QED potentials for all-electron 4-component relativistic molecular calculations using the DIRAC code. The potentials are also available fo…