Additions to “Atomistic Understanding of the Formation, Structure, and Decomposition of an Fe<sub>4</sub>C Iron Carbide Phase on a Copper Substrate”-Reference-Cited by-同舟云学术

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Additions to “Atomistic Understanding of the Formation, Structure, and Decomposition of an Fe₄C Iron Carbide Phase on a Copper Substrate”

Published:2023-10-16 Issue:42 Volume:127 Page:20972-20973
ISSN:1932-7447
Container-title:The Journal of Physical Chemistry C
language:en
Short-container-title:J. Phys. Chem. C

Author:

Gubo Richard^ORCID,Ren Pengju^ORCID,Rodríguez Daniel García,Yu Xin^ORCID,Zhang Tianfu,Wen Xiaodong^ORCID,Yang Yong^ORCID,Li Yong-Wang,Niemantsverdriet J. W.,Weststrate C. J.^ORCID

Funder

National Natural Science Foundation of China

Chinese Academy of Sciences

Synfuels China Technology Co. Ltd.

Netherlands Organization for Scientific Research

Beijing Advanced Innovation Center for Materials Genome Engineering

Syngaschem BV

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.3c06335

Reference4 articles.

1. Structure and stability of Fe4C bulk and surfaces: A density functional theory study

2. Electronic structure and magnetic properties of bulk and (001) surfaces of γ′-Fe4C from first principles

3. Ab initio investigation of the substitution effects of 2p elements on the electronic structure of γ-Fe4X (X = B, C, N, and O) in the ground state

4. Crystal structures of Fe4C vs. Fe4N analysed by DFT calculations: Fcc-based interstitial superstructures explored

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