메뉴 건너뛰기




Volumn 392, Issue 4-6, 2004, Pages 533-540

Time-dependent multiconfiguration theory for electronic dynamics of molecules in an intense laser field

Author keywords

[No Author keywords available]

Indexed keywords

ACCELERATION; ARTICLE; CALCULATION; CORRELATION COEFFICIENT; ELECTRIC FIELD; ELECTRONICS; HYDROGENATION; LASER; MOLECULAR DYNAMICS; MOLECULAR INTERACTION; THEORY; TIME PERCEPTION;

EID: 3042674959     PISSN: 00092614     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.cplett.2004.05.106     Document Type: Article
Times cited : (300)

References (32)
  • 23
    • 3042676979 scopus 로고    scopus 로고
    • note
    • kk≤1 [24]. Thus, the assumption used in Eq. (12) is satisfied if we expand the wave function with a physical set of molecular orbitals
  • 26
    • 3042525643 scopus 로고    scopus 로고
    • note
    • In general, the orbital transformation of Eq. (21) does not conserve the norm of the wave function of Eq. (4) because of the incomplete length of the determinantal expansion of the wave function (except for the full-CI expansion and the trivial single determinantal TDHF approximation). However, we can evolve the wave function by a unitary scheme that is accurate up to the second-order in Δt. Details of the unitary integration of the coupled nonlinear equations will be reported elsewhere


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.