Numerical solution of the Born‐Green equation for the pair potential | Zendy

Waseda Y. | Zendy; Suzuki K. | Zendy

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Numerical solution of the Born‐Green equation for the pair potential

Author(s) -

Waseda Y.,

Suzuki K.

Publication year - 1971

Publication title -

physica status solidi (b)

Language(s) - English

Resource type - Journals

SCImago Journal Rank - 0.51

H-Index - 109

eISSN - 1521-3951

pISSN - 0370-1972

DOI - 10.1002/pssb.2220470125

Subject(s) - pair potential , integral equation , lennard jones potential , function (biology) , mathematics , numerical analysis , range (aeronautics) , green's function , mathematical analysis , physics , thermodynamics , quantum mechanics , materials science , molecular dynamics , evolutionary biology , biology , composite material

To derive the pair potential from observed structural data the Born‐Green equation has been numerically solved by a linearized simultaneous equation method without any initial function. Liquid Cs has a long‐range oscillatory potential, whereas liquid Ar has a Lennard‐Jones type potential. Problems such as truncating the infinite integral at a finite upper value in computing the pair potential have been discussed by means of numerical analysis.

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