Ko, Won-Seok Shim, Jae-Hyeok Lee, Byeong-Joo 2024-01-20T17:01:33Z 2024-01-20T17:01:33Z 2021-09-05 2011-06 0884-2914 https://pubs.kist.re.kr/handle/201004/130300 Second nearest-neighbor modified embedded-atom method (MEAM) interatomic potentials for the Al-H and Ni-H binary systems have been developed on the basis of previously developed MEAM potentials of pure Al, Ni, and H. The potentials can describe various fundamental physical properties of the relevant binary alloys (structural, thermodynamic, defect, and dynamic properties of metastable hydrides or hydrogen in face-centered cubic solid solutions) in good agreement with experiments or first-principles calculations. The applicability of the present potentials to atomic level investigations of dynamic behavior of hydrogen atoms in metal membranes is also discussed. English CAMBRIDGE UNIV PRESS EMBEDDED-ATOM-METHOD HYDROGEN PERMEATION CHARACTERISTICS LOSLICHKEIT VON WASSERSTOFF LIQUID-METAL EMBRITTLEMENT SINGLE-CRYSTAL HIGH-PRESSURE INTERATOMIC POTENTIALS FATIGUE BEHAVIOR LATTICE-DEFECTS ALUMINUM Atomistic modeling of the Al-H and Ni-H systems Article 10.1557/jmr.2011.95 1 JOURNAL OF MATERIALS RESEARCH, v.26, no.12, pp.1552 - 1560 JOURNAL OF MATERIALS RESEARCH 26 12 1552 1560 scie scopus 000292831700013 2-s2.0-81455159210 Materials Science, Multidisciplinary Materials Science Article EMBEDDED-ATOM-METHOD HYDROGEN PERMEATION CHARACTERISTICS LOSLICHKEIT VON WASSERSTOFF LIQUID-METAL EMBRITTLEMENT SINGLE-CRYSTAL HIGH-PRESSURE INTERATOMIC POTENTIALS FATIGUE BEHAVIOR LATTICE-DEFECTS ALUMINUM Diffusion H Simulation