Progress in the development of a molecular dynamics code for high-energy cascade studies

Polymorphic transitions in single crystals: A new molecular dynamics method

Michele Parrinello, A. Rahman · Journal of Applied Physics · 1981 · 20.2K citations

Natural Sciences, Chemistry, Physics +15

Embedded-atom method: Derivation and application to impurities, surfaces, and other defects in metals

Murray S. Daw, M. I. Baskes · Physical review. B, Condensed matter · 1984 · 7.2K citations

Natural Sciences, Materials Science, Physics +17

Computer simulation of local order in condensed phases of silicon

Frank H. Stillinger, Thomas A. Weber · Physical review. B, Condensed matter · 1985 · 5.3K citations

Natural Sciences, Materials Science, Physics +16

Embedded-atom-method functions for the fcc metals Cu, Ag, Au, Ni, Pd, Pt, and their alloys

Stephen M. Foiles, M. I. Baskes, Murray S. Daw · Physical review. B, Condensed matter · 1986 · 4.6K citations

Natural Sciences, Materials Science, Physics +17

Modeling solid-state chemistry: Interatomic potentials for multicomponent systems

J. Tersoff · Physical review. B, Condensed matter · 1989 · 4.1K citations

Natural Sciences, Chemistry, Materials Science +17