Study of Tritium Diffusivity in Pure and Sn-Defective Zr: A First-Principles Density Functional Theory Approach-Reference-Cited by-同舟云学术

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Study of Tritium Diffusivity in Pure and Sn-Defective Zr: A First-Principles Density Functional Theory Approach

Published:2023-06-23 Issue:26 Volume:127 Page:12435-12443
ISSN:1932-7447
Container-title:The Journal of Physical Chemistry C
language:en
Short-container-title:J. Phys. Chem. C

Author:

Paudel Hari P.¹²,Jia Ting¹,Saidi Wissam A.¹^ORCID,Senor David J.³,Casella Andrew M.³,Duan Yuhua¹^ORCID

Affiliation:

1. United States Department of Energy, National Energy Technology Laboratory, Pittsburgh, Pennsylvania 15236, United States

2. NETL Support Contractor, 626 Cochrans Mill Road, Pittsburgh, Pennsylvania 15236-0940, United States

3. Pacific Northwest National Laboratory, Richland, Washington 99354, United States

Funder

National Nuclear Security Administration

Publisher

American Chemical Society (ACS)

Subject

Surfaces, Coatings and Films,Physical and Theoretical Chemistry,General Energy,Electronic, Optical and Magnetic Materials

Link

https://pubs.acs.org/doi/pdf/10.1021/acs.jpcc.3c01200

Reference41 articles.

1. Diffusion coefficient of hydrogen in alpha zirconium, Zircaloy-2 and Zircaloy-4

2. Tritium Diffusion Pathways in γ-LiAlO2 Pellets Used in TPBAR: A First-Principles Density Functional Theory Investigation

3. Hydrogen localization and cluster formation in α-Zr from first-principles investigations

4. Corrosion of Zirconium Alloys Used for Nuclear Fuel Cladding

5. Zirconium alloys in nuclear power

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