Molecular dynamics studies of irradiation effects on hydrogen isotope diffusion through nickel crystals and grain boundaries-Reference-Cited by-同舟云学术

Molecular dynamics studies of irradiation effects on hydrogen isotope diffusion through nickel crystals and grain boundaries

Published:2018 Issue:1 Volume:20 Page:520-534
ISSN:1463-9076
Container-title:Physical Chemistry Chemical Physics
language:en
Short-container-title:Phys. Chem. Chem. Phys.

Author:

Zhou X. W.¹²³^ORCID,Dingreville R.¹⁴³,Karnesky R. A.¹²³

Affiliation:

1. Sandia National Laboratories

2. Livermore

3. USA

4. Albuquerque

Abstract

Molecular dynamics construction of the Arrhenius plot accounts for all possible diffusion paths in defective materials.

Funder

National Nuclear Security Administration

Publisher

Royal Society of Chemistry (RSC)

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

http://pubs.rsc.org/en/content/articlepdf/2018/CP/C7CP06086F

Reference27 articles.

1. Molecular Dynamics Simulations of Hydrogen Diffusion in Aluminum

2. The diffusion and trapping of hydrogen in high purity aluminum

3. X. W. Zhou , T. W.Heo , B. C.Wood , V.Stavila , S.Kang and M. D.Allendorf , Temperature- and Composition-Dependent Hydrogen Diffusivity in Palladium from Statistically-Averaged Molecular Dynamics , submitted

4. Lattice and Grain Boundary Self‐Diffusion in Silver

Cited by 24 articles. 订阅此论文施引文献订阅此论文施引文献，注册后可以免费订阅5篇论文的施引文献，订阅后可以查看论文全部施引文献

1. Stochastic symplectic reduced-order modeling for model-form uncertainty quantification in molecular dynamics simulations in various statistical ensembles;Computer Methods in Applied Mechanics and Engineering;2024-11

2. Applied electric field to repair metal defects and accelerate dehydrogenation;Modelling and Simulation in Materials Science and Engineering;2024-03-08

3. Hydrogen trapping and diffusion in polycrystalline nickel: The spectrum of grain boundary segregation;Journal of Materials Science & Technology;2024-02

4. Primary irradiation damage in Ni–graphene nanocomposites with pre-existing hydrogen: insights from atomistic simulations;The European Physical Journal Plus;2024-01-05

5. Superior hydrogen permeation resistance via Ni–graphene nanocomposites: Insights from atomistic simulations;Journal of Materials Research and Technology;2024-01