{"bio" "" "city" "Yokosuka-shi, Kanagawa-ken" "country" "JP" "department" "Materials Science Laboratory" "description-of-work" "Charge transfer potential for silica \r\nModified Tersoff potential for silicon \r\nTersoff potential for Si-B \r\nEAM potential for Zr-Ni \r\ngeneralized EAM potential for Ru \r\nScreened Tersoff potential for carbon \r\nMorse potential for silicon clathrate \r\nBond-order potential for Fe-Cr-C\r\n\r\nMaterials\r\nsilica \r\nsilicon \r\nboron in silicon \r\nZr-Ni metallic glass \r\nRu \r\namorphous carbon \r\nsilicon clathrate \r\nChromium carbide in iron\r\n\r\nBibliography\r\nT. Kumagai, S. Hara, S. Izumi, S. Sakai, “Development of a bond-order type interatomic potential for Si-B systems”, Modeling and Simulation in Materials Science and Engineering, Vol. 14, pp.S29-S37 (2006). \r\nT. Kumagai, S. Izumi, S. Hara, S. Sakai ,\"Development of bond-order potentials that can reproduce the elastic constants and melting point of silicon for classical molecular dynamics simulation\", Computational Materials Science,Vol.39, pp.457-464(2007) \r\nT. Kumagai, S. Izumi, S. Hara, S. Sakai ,\"Development of bond-order potentials that can reproduce the elastic constants and melting point of silicon for classical molecular dynamics simulation\", Computational Materials Science,Vol.39, pp.457-464(2007). \r\nT. Kumagai, D. Nikkuni, S. Hara, S. Izumi, S. Sakai ,\"Development of interatomic potential for Zr-Ni amorphous systems\", Materials Transactions,Vol.48, pp.1313-1321(2007). \r\nT. Kumagai, S. Hara, J. Choi, S. Izumi, T. Kato ,\"Development of empirical bond-order-type interatomic potential for amorphous carbon structures\", Journal of Applied Physics,Vol.105article number64310 (2009). \r\nS. Hara, T. Kumagai, S. Izumi, S. Sakai, \"Multiscale analysis on the onset of nanoindentation-induced delamination: Effect of high-modulus Ru overlayer\", Acta Materialia,Vol.57, pp.4209-4216(2009). \r\nT. Kumagai, K. Nakamura, S. Yamada, T. Ohnuma, \"Simple bond-order-type interatomic potential for an intermixed Fe-Cr-C system of metallic and covalent bondings in heat-resistant ferritic steels\", Journal of Applied Physics, Vol.116, article number 4904447 (2014). \r\nM. Arai, Y. Takahashi, T. Kumagai, \"Determination of high-temperature elastoplastic properties of welded joints by indentation test\", Materials at High Temperatures, Vol. 32, pp.475-482 (2015). \r\nT. Kumagai, K. Nakamura, S. Yamada, T. Ohnuma, \"Effects of guest atomic species on the lattice thermal conductivity of type-I silicon clathrate studied via classical molecular dynamics\", Journal of Chemical Physics, Vol.145, article number 64702 (2016). \r\n" "email" "kumagai@criepi.denken.or.jp" "first-name" "Tomohisa" "institution" "Central Research Institute of Electric Power Industry" "kim-items-contributor" [] "kim-items-developer" ["Sim_LAMMPS_ModifiedTersoff_KumagaiIzumiHara_2007_Si__SM_773333226968_000"] "kim-items-implementer" [] "last-name" "Kumagai" "link-rel-canonical-url" "https://openkim.org/profile/kumagai" "location-merged" "Yokosuka-shi, Kanagawa-ken, Japan" "openkim-user-id" #uuid "bd60bce7-3503-4782-afa4-26ec2e69707a" "page-title" "Tomohisa Kumagai" "profile-picture" "" "published-name" "Tomohisa Kumagai" "state" "" "title" "Dr." "username" "kumagai" "website" "https://criepi.denken.or.jp"}