Application of finite-element method to
β
Nobuyuki Sato; Suehiro Iwata
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Article
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1988
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John Wiley and Sons
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English
β 797 KB
An algorithm to solve the two-dimensional Schrodinger equation based on the finite-element method is proposed. In our scheme, the molecular Hamiltonian with any arbitrary internal coordinate system can be solved as easily as with the Cartesian coordinate system. The efficient computer program based