most citedTime-dependent restricted-active-space self-consistent-field theory for laser-driven many-electron dynamics. II. Extended formulation and numerical analysis

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physics.atom-ph2014★ 45 cited

Time-dependent restricted-active-space self-consistent-field singles method for many-electron dynamics

Haruhide Miyagi, Lars Bojer Madsen

The time-dependent restricted-active-space self-consistent-field singles (TD-RASSCF-S) method is presented for investigating TD many-electron dynamics in atoms and molecules. Adopt…