{"description" "This is a driver, tuned for efficiency, for the Lennard-Jones (LJ) 6-12 pair potential model. It supports the option to be truncated to have zero energy above a specified cutoff radius or shifted to have a continuous energy at the cutoff radius. The driver is capable of supporting multiple species interactions. If only \"like-like\" interactions are specified then the driver use the Lorentz-Berthelot mixing rules to generate the unlike interaction parameters. See the README file for details." "domain" "openkim.org" "extended-id" "LennardJones612__MD_414112407348_000" "kim-api-version" "1.6" "source-citations" "J. E. Jones, \"On the Determination of Molecular Fields. I. From the Variation of the Viscosity of a Gas with Temperature\", Proc. R. Soc. London, Ser. A, 106(738):441-462, 1924.\n\n J. E. Jones, \"On the Determination of Molecular Fields. II. From the Equation of State of a Gas\", Proc. R. Soc. London, Ser. A, 106(738):463-477, 1924.\n\nJ. E. Lennard-Jones, \"On the Forces between Atoms and Ions\", Proc. R. Soc. London, Ser. A, 109(752):584-597, 1925." "title" "Efficient KIM model driver for the multi-species Lennard-Jones model with truncated or shifted cutoff" "creator" "Ryan S. Elliott" "contributor-id" "b645a915-d1fa-4155-a3da-65469f990011" "maintainer-id" "b645a915-d1fa-4155-a3da-65469f990011" "publication-year" "2015"}