A bond-order potential for the Al–Cu–H ternary system-Reference-Cited by-同舟云学术

A bond-order potential for the Al–Cu–H ternary system

Published:2018 Issue:7 Volume:42 Page:5215-5228
ISSN:1144-0546
Container-title:New Journal of Chemistry
language:en
Short-container-title:New J. Chem.

Author:

Zhou X. W.¹²³⁴^ORCID,Ward D. K.⁵²³⁴,Foster M. E.⁶²³⁴

Affiliation:

1. Mechanics of Materials Department

2. Sandia National Laboratories

3. Livermore

4. USA

5. Radiation and Nuclear Detection Materials and Analysis Department

6. Materials Physics Department

Abstract

The new potential enables simulations of H₂ interactions with Al alloy surfaces.

Funder

National Nuclear Security Administration

Publisher

Royal Society of Chemistry (RSC)

Subject

Materials Chemistry,General Chemistry,Catalysis

Link

http://pubs.rsc.org/en/content/articlepdf/2018/NJ/C8NJ00513C

Reference87 articles.

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3. J. L. Murray , Phase Diagrams of Binary Copper Alloys , ed. P. R. Subramanian , D. J. Chakrabarti and D. E. Laughlin , ASM International , Materials Park, OH , 1994

4. Thermodynamic evaluation of the Al-H system

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