The Effect of Hydrogen on the Stress-Strain Response in Fe<sub>3</sub>Al: An ab initio Molecular-Dynamics Study

The Effect of Hydrogen on the Stress-Strain Response in Fe<sub>3</sub>Al: An ab initio Molecular-Dynamics Study

We performed a quantum-mechanical molecular-dynamics (MD) study of Fe<inline-formula><math xmlns="http://www.w3.org/1998/Math/MathML" display="inline"><semantics><msub><mrow></mrow><mn>3</mn></msub></semantics></math&...

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Bibliographic Details
Main Authors: Petr Šesták, Martin Friák, Mojmír Šob
Format: Article
Language:English
Published: MDPI AG 2021-07-01
Series:Materials
Subjects:
Fe3Al
hydrogen
embrittlement
molecular dynamics
strength
ab initio
Online Access:https://www.mdpi.com/1996-1944/14/15/4155

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