東京大学 大学院工学系研究科 石川研究室

Archives : Oct, 2013

Time-dependent complete-active-space self-consistent field method for multielectron dynamics in intense laser fields

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Abstract: The time-dependent complete-active-space self-consistent-field (TD-CASSCF) method for the description of multielectron dynamics in intense laser fields is presented, and a comprehensive description of the method is given. It introduces the concept of frozen-core (to model tightly bound electrons with no response to the field), dynamical-core (to model electrons tightly bound but responding to the field), and active (fully correlate...