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Motoyuki Shiga
Japan Atomic Energy Agency - Center for Computational Science and e-Systems
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SCHOLARLY PAPERS
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Scholarly Papers (1)
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1.
Accurate Description of Hydrogen Diffusivity in bcc Metals Using Machine-Learning Moment Tensor Potentials and Path-Integral Methods
Number of pages: 68
Posted: 25 Oct 2022
Hyukjoon Kwon
, Motoyuki Shiga,
Hajime Kimizuka
and
Takuji Oda
Seoul National University - Department of Nuclear Engineering, Japan Atomic Energy Agency - Center for Computational Science and e-Systems, Nagoya University - Department of Materials Design Innovation Engineering and Seoul National University - Department of Nuclear Engineering
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Abstract:
Hydrogen diffusion; Molecular dynamics (MD); Density Functional Theory
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