Theoretical study on the structural properties of alkali-metal heteroclusters

Global Optimization by Basin-Hopping and the Lowest Energy Structures of Lennard-Jones Clusters Containing up to 110 Atoms

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Global optimization by basin-hopping and the lowest energy structures of Lennard-Jones clusters containing up to 110 atoms

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Tight-binding potentials for transition metals and alloys

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Monte Carlo-minimization approach to the multiple-minima problem in protein folding.

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Lattice relaxation at a metal surface

Raju P. Gupta · Physical review. B, Condensed matter · 1981 · 765 citations

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