Vacancy and phonon dispersion properties of Be, Co, Hf, Mg, and Re by modified embedded atom method potentials
Sign Up to like & getrecommendations! Published in 2021 at "Journal of Molecular Modeling"
DOI: 10.1007/s00894-021-04759-4
Abstract: The modified embedded atom method (MEAM) potentials improved by Jin et al. (Appl. Phys. A120 (2015), p. 189) were applied to calculate the mono- and bi-vacancy properties as well as the phonon dispersions for hexagonal… read more here.
Keywords: modified embedded; embedded atom; phonon dispersion; vacancy ... See more keywords
Modified embedded-atom method potential for cadmium
Sign Up to like & getrecommendations! Published in 2019 at "Hyperfine Interactions"
DOI: 10.1007/s10751-019-1640-5
Abstract: The second nearest-neighbor modified embedded atom method (2NN MEAM) is a semi-empirical simulation technique designed to calculate materials properties of metallic and covalent solids. It is a strong candidate for calculation of site occupation, defect… read more here.
Keywords: modified embedded; embedded atom; potential cadmium; cadmium ... See more keywords
Atomistic modeling of metallic thin films by modified embedded atom method
Sign Up to like & getrecommendations! Published in 2017 at "Applied Surface Science"
DOI: 10.1016/j.apsusc.2017.05.011
Abstract: Abstract Molecular dynamics simulation is applied to investigate the deposition process of metallic thin films. Eight metals, titanium, vanadium, iron, cobalt, nickel, copper, tungsten, and gold, are chosen to be deposited on the aluminum substrate.… read more here.
Keywords: modified embedded; metallic thin; thin films; embedded atom ... See more keywords
A modified embedded-atom method interatomic potential for bismuth
Sign Up to like & getrecommendations! Published in 2021 at "Modelling and Simulation in Materials Science and Engineering"
DOI: 10.1088/1361-651x/ac095c
Abstract: A semi-empirical interatomic potential for the post-transition metal, bismuth, is developed based on the second nearest-neighbor modified embedded-atom method (MEAM). The potential reproduces a range of physical properties, such as the lattice constant, cohesive energy,… read more here.
Keywords: interatomic potential; bismuth; embedded atom; atom method ... See more keywords
Molecular Dynamics Simulations of PtTi High-Temperature Shape Memory Alloys Based on a Modified Embedded-Atom Method Interatomic Potential
Sign Up to like & getrecommendations! Published in 2022 at "Materials"
DOI: 10.3390/ma15155104
Abstract: A new second nearest-neighbor modified embedded-atom model-based PtTi binary interatomic potential was developed by improving the pure Pt unary descriptions of the pre-existing interatomic potential. Specifically, the interatomic potential was developed focusing on the shape… read more here.
Keywords: temperature; interatomic potential; shape memory; modified embedded ... See more keywords
A Modified Embedded-Atom Method Potential for a Quaternary Fe-Cr-Si-Mo Solid Solution Alloy
Sign Up to like & getrecommendations! Published in 2023 at "Materials"
DOI: 10.3390/ma16072825
Abstract: Ferritic-martensitic steels, such as T91, are candidate materials for high-temperature applications, including superheaters, heat exchangers, and advanced nuclear reactors. Considering these alloys’ wide applications, an atomistic understanding of the underlying mechanisms responsible for their excellent… read more here.
Keywords: embedded atom; potential quaternary; atom method; modified embedded ... See more keywords