{ "title" "Three-body Stillinger-Weber (SW) Model Driver" "extended-id" "Three_Body_Stillinger_Weber__MD_335816936951_002" "creator" "Mingjian Wen" "description" "This is a model driver for the generalized Stillinger-Weber (SW) three-body potential supporting multiple species. It is consistent with 'pair_style sw' in the LAMMPS package, but the parameter file has a different format and the driver is less general than the LAMMPS implementation. Specifically, in the KIM parameter file, only independent pairwise parameters are read in and the three-body parameters are generated through geometric averaging. In addition, the costheta_0 parameter is assumed to be the same for all three-body interactions and the tolerance parameter introduced in LAMMPS for efficiency is not supported. See the README file for details. A Python utility \"lammps_sw_2_kim_sw.py\" is provided to translate LAMMPS pair_style sw parameter files to the KIM model driver format." "source-citations" [{"title" "Computer simulation of local order in condensed phases of silicon" "author" "Stillinger, Frank H. and Weber, Thomas A." "journal" "Physical Review B" "volume" "31" "issue" "8" "pages" "5262--5271" "year" "1985" "month" "Apr" "publisher" "American Physical Society" "doi" "10.1103/PhysRevB.31.5262" "url" "https://link.aps.org/doi/10.1103/PhysRevB.31.5262" "recordtype" "article" "recordkey" "MD_335816936951_002a"} {"title" "Modeling Materials: {C}ontinuum, Atomistic and Multiscale Techniques" "author" "Tadmor, Ellad B. and Miller, Ronald E." "year" "2011" "publisher" "Cambridge University Press" "doi" "10.1017/CBO9781139003582" "recordtype" "book" "recordkey" "MD_335816936951_002b"} {"title" "Stillinger-Weber potential for the II-VI elements Zn-Cd-Hg-S-Se-Te" "author" "Zhou, X. W. and Ward, D. K. and Martin, J. E. and van Swol, F. B. and Cruz-Campa, J. L. and Zubia, D." "journal" "Physical Review B" "volume" "88" "issue" "8" "pages" "085309" "numpages" "14" "year" "2013" "month" "Aug" "publisher" "American Physical Society" "doi" "10.1103/PhysRevB.88.085309" "url" "https://link.aps.org/doi/10.1103/PhysRevB.88.085309" "recordtype" "article" "recordkey" "MD_335816936951_002c"}] "contributor-id" "5ca58a6a-aa46-4e5a-a2e1-b3fc6bc2efa6" "maintainer-id" "5ca58a6a-aa46-4e5a-a2e1-b3fc6bc2efa6" "publication-year" "2016" "kim-api-version" "1.6" "executables" ["lammps_sw_2_kim_sw.py"] "domain" "openkim.org" }