Accurate simulation of surfaces and interfaces of ten FCC metals and steel using Lennard–Jones potentials

Abstract The earlier integration of validated Lennard–Jones (LJ) potentials for 8 fcc metals into materials and biomolecular force fields has advanced multiple research fields, for example, metal–electrolyte interfaces, recognition of biomolecules, colloidal assembly of metal nanostructures, alloys,...

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Bibliographic Details
Main Authors: Krishan Kanhaiya, Seonghan Kim, Wonpil Im, Hendrik Heinz
Format: article
Language:EN
Published: Nature Portfolio 2021
Subjects:
Online Access:https://doaj.org/article/a2ab75e10fcf466dbf2f7b76ecfad3d1
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