Fourier grid Hamiltonian multiconfigurational self-consistent-field: A method to calculate multidimensional hydrogen vibrational wavefunctions

Journal of Chemical Physics

Volumn 113, Issue 13, 2000, Pages 5214-5227

  Webb, Simon P ^a   Hammes Schiffer, Sharon ^a  

^a PENNSYLVANIA STATE UNIVERSITY   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

EIGENVALUES AND EIGENFUNCTIONS; ELECTRONIC STRUCTURE; FAST FOURIER TRANSFORMS; GROUND STATE; HYDROGEN; INTEGRAL EQUATIONS; MATRIX ALGEBRA; MOLECULAR PHYSICS; NUCLEAR PHYSICS; PHYSICAL CHEMISTRY; POTENTIAL ENERGY; QUANTUM THEORY;

FOURIER GRID MULTICONFIGURATIONAL SELF-CONSISTENT-FIELD METHOD; WAVEFUNCTIONS;

MOLECULAR VIBRATIONS;

EID: 0034300544     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.1289528     Document Type: Article

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