Biaxial compressive strain enhances calcium binding and mobility on two-dimensional Sc<sub>2</sub>C: a density functional theory investigation-Reference-Cited by-同舟云学术

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Biaxial compressive strain enhances calcium binding and mobility on two-dimensional Sc₂C: a density functional theory investigation

Published:2024 Issue:5 Volume:26 Page:4298-4305
ISSN:1463-9076
Container-title:Physical Chemistry Chemical Physics
language:en
Short-container-title:Phys. Chem. Chem. Phys.

Author:

Putungan Darwin B.¹^ORCID,Llemit Christian Loer T.¹,Santos-Putungan Alexandra B.¹,Sarmago Roland V.²,Gebauer Ralph³^ORCID

Affiliation:

1. Physics Division, Institute of Mathematical Sciences and Physics, University of the Philippines Los Baños, College, Los Baños, Laguna, Philippines

2. National Institute of Physics, University of the Philippines Diliman, Quezon City, Philippines

3. Condensed Matter and Statistical Physics Group, The Abdus Salam International Center for Theoretical Physics, Trieste, Italy

Abstract

Biaxial compressive strain on the Sc2C monolayer enhances calcium's binding energy and significantly reduces its diffusion energy barrier.

Publisher

Royal Society of Chemistry (RSC)

Link

http://pubs.rsc.org/en/content/articlepdf/2024/CP/D3CP04897G

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