Open AccessStatistically averaged molecular dynamics simulations of hydrogen diffusion in magnesium and magnesium hydrides
Author(s) -
Catalin D. Spataru,
Tae Wook Heo,
Brandon C. Wood,
Vitalie Stavila,
ShinYoung Kang,
Mark D. Allendorf,
Xiaowang Zhou
Publication year - 2020
Publication title -
physical review materials
Language(s) - English
Resource type - Journals
SCImago Journal Rank - 1.439
H-Index - 42
eISSN - 2476-0455
pISSN - 2475-9953
DOI - 10.1103/physrevmaterials.4.105401
Subject(s) - magnesium , magnesium hydride , hydrogen , molecular dynamics , materials science , hydrogen storage , hydride , diffusion , tetragonal crystal system , kinetics , arrhenius equation , inorganic chemistry , thermodynamics , chemistry , crystal structure , crystallography , activation energy , computational chemistry , metallurgy , organic chemistry , physics , quantum mechanics
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