{"content-origin" "http://cmse.postech.ac.kr/home_2nnmeam" "contributor-id" "110ed980-fee3-438f-be70-54d48c808843" "description" "Second-nearest-neighbor modified embedded-atom method (2NN MEAM) interatomic potential for Cu-Co binary systems has been developed. The Cu-Co potential can be extended to Pt-Cu-Co ternary 2NN MEAM potential being combined with already existing Pt-Co potential and can be utilized for atomistic simulations to design inexpensive and efficient platinum alloy catalysts. The potential reproduces fundamental material properties such as structural and thermodynamic properties of compound and solution phases in reasonable agreement with experimental data." "developer" ["110ed980-fee3-438f-be70-54d48c808843" "95e0e2ff-c708-4e28-830e-8655b8198fe1" "c8ad0beb-f4c8-4ddc-8a25-372f5cc4a17e"] "doi" "10.25950/fce862f7" "domain" "openkim.org" "executables" [] "extended-id" "MEAM_LAMMPS_WangOhLee_2020_CuCo__MO_694335101831_001" "kim-api-version" "2.2" "maintainer-id" "110ed980-fee3-438f-be70-54d48c808843" "model-driver" "MEAM_LAMMPS__MD_249792265679_001" "potential-type" "meam" "publication-year" "2021" "source-citations" [{"abstract" "Second-nearest-neighbor modified embedded-atom method (2NN MEAM) interatomic potentials for Cu-M (M = Co, Mo) binary systems have been developed. The Cu-M potentials can be extended to Pt-Cu-M ternary 2NN MEAM potentials being combined with already existing Pt-M potentials and can be utilized for atomistic simulations to design inexpensive and efficient platinum alloy catalysts. The potentials reproduce fundamental material properties such as structural and thermodynamic properties of compound and solution phases in reasonable agreement with experimental data. Herein, the validity of the developed potentials for atomistic simulation is ascertained." "author" "Wang, Jaemin and Oh, Sang-Ho and Lee, Byeong-Joo" "doi" "10.1016/j.commatsci.2020.109627" "issn" "0927-0256" "journal" "Computational Materials Science" "keywords" "2NN MEAM, Interatomic potential, Atomistic simulation, Cu-Co, Cu-Mo, Pt-Cu-M" "pages" "109627" "recordkey" "MO_694335101831_001a" "recordprimary" "recordprimary" "recordtype" "article" "title" "Second-nearest-neighbor modified embedded-atom method interatomic potential for {C}u-{M} ({M} = {C}o, {M}o) binary systems" "url" "http://www.sciencedirect.com/science/article/pii/S092702562030118X" "volume" "178" "year" "2020"}] "species" ["Cu" "Co"] "title" "MEAM Potential for the Cu-Co system developed by Wang et al. (2020) v001"}