Last Update:2021/03/05

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AvailabilityK supercomputer, Xeon 2.96GHz, ISSP system B (SGI Altix ICE), and NEC SX
Core DevelopersYoshitada Morikawa (Graduate School of Engineering, Osaka University)
Target substance/modelSolid–fluid interface
Physical quantities that can be computedElectron state, reaction path, and activation barrier
MethodologyPlane wave ground state first-principles molecular dynamics
Related keywords