{ "content-origin" "http://www.ctcms.nist.gov/potentials/Pb.html" "contributor-id" "ef8a3037-b0a8-400a-9eb2-096acbc02685" "description" "Empirical many-body potentials of the glue-type have been constructed for the Al\u2013Pb system using the 'force matching' method. The potentials are fitted to experimental data, physical quantities derived from ab initio linear muffin-tin orbitals calculations and a massive quantum mechanical database of atomic forces generated using ultrasoft pseudopotentials in conjunction with ab initio molecular statics simulations. Monte Carlo simulations using these potentials have been employed to compute an Al\u2013Pb phase diagram which is in fair agreement with experimental data." "developer" [ "ef8a3037-b0a8-400a-9eb2-096acbc02685" "8c4717b1-1119-4c3e-a0d5-91ca55edc562" "dfa59905-98ff-4499-9d7a-d839b3c3070f" "ba72d8e2-f5fb-4a80-9802-d83599b2d981" "709909da-42d0-4f42-9878-5c92d5ef7176" "e80c17f0-a08e-4790-a835-cc884729bbc0" ] "doi" "10.25950/d9f84889" "domain" "openkim.org" "extended-id" "EAM_Dynamo_LandaWynblattSiegel_2000_AlPb__MO_699137396381_005" "kim-api-version" "2.0" "maintainer-id" "ef8a3037-b0a8-400a-9eb2-096acbc02685" "model-driver" "EAM_Dynamo__MD_120291908751_005" "potential-type" "eam" "publication-year" "2018" "source-citations" [ { "author" "A. Landa and P. Wynblatt and D. J. Siegel and J. B. Adams and O. N. Myrasov and X.-Y. Liu" "doi" "10.1016/S1359-6454(00)00002-1" "issn" "1359-6454" "journal" "Acta Materialia" "number" "8" "pages" "1753--1761" "recordkey" "MO_699137396381_005a" "recordprimary" "recordprimary" "recordtype" "article" "title" "Development of glue-type potentials for the {A}l--{P}b system: phase diagram calculation" "volume" "48" "year" "2000" } { "author" "A. Landa and P. Wynblatt and D. J. Siegel and J. B. Adams and O. N. Myrasov and X.-Y. Liu" "doi" "10.1016/S1359-6454(00)00158-0" "issn" "1359-6454" "journal" "Acta Materialia" "number" "13" "pages" "3621" "recordkey" "MO_699137396381_005b" "recordtype" "article" "title" "Corrigendum: {D}evelopment of glue-type potentials for the {A}l--{P}b system: phase diagram calculation" "volume" "48" "year" "2000" } { "author" "A. Landa and P. Wynblatt and E. Johnson and U. Dahmen" "doi" "10.1016/S1359-6454(00)00059-8" "issn" "1359-6454" "journal" "Acta Materialia" "number" "10" "pages" "2557--2563" "recordkey" "MO_699137396381_005c" "recordtype" "article" "title" "Computer simulation of P{b}/{A}l interfaces" "volume" "48" "year" "2000" } ] "species" [ "Al" "Pb" ] "title" "Glue potential (LAMMPS cubic hermite tabulation) for the Al-Pb system developed by Landa et al. (2000) v005" }