Fourier Grid Hamiltonian method for solving the vibrational Schrödinger equation in internal coordinates: Theory and test applications

Journal of Physical Chemistry A

Volumn 107, Issue 37, 2003, Pages 7204-7214

  Stare, Jernej ^a   Balint Kurti, Gabriel G ^b  

^a NATIONAL INSTITUTE OF CHEMISTRY   (Slovenia)

^b UNIVERSITY OF BRISTOL   (United Kingdom)

Author keywords

[No Author keywords available]

Indexed keywords

FOURIER TRANSFORMS; HAMILTONIANS; HYDROGEN BONDS; NUMERICAL ANALYSIS;

FOURIER GRID HAMILTONIAN METHOD; MOLECULAR SYSTEMS; VIBRATIONAL SCHRODINGER EQUATION;

MOLECULAR VIBRATIONS;

EID: 0141459153     PISSN: 10895639     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp034440z     Document Type: Article

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