Computing tunneling paths with the Hamilton-Jacobi equation and the fast marching method

Molecular Physics

Volumn 105, Issue 1, 2007, Pages 71-83

  Dey, Bijoy K ^a,b   Ayers, Paul W ^a  

^a MCMASTER UNIVERSITY   (Canada)

^b FREIE UNIVERSITÄT BERLIN   (Germany)

Author keywords

Ab initio; Computational chemistry; Electronic structure; Quantum chemistry

Indexed keywords

APPROXIMATION THEORY; BACKPROPAGATION; ELECTRONIC STRUCTURE; HAMILTONIANS; MOLECULAR PHYSICS; OPTIMIZATION; POTENTIAL ENERGY;

COMPUTATIONAL CHEMISTRY; HAMILTON-JACOBI EQUATIONS; QUANTUM CHEMISTRY;

NONLINEAR EQUATIONS;

EID: 33847283956     PISSN: 00268976     EISSN: 13623028     Source Type: Journal    
DOI: 10.1080/00268970601131999     Document Type: Article

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