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Works (42)

Dislocation Loop Transformation in Metals: Computational Studies, Theoretical Prediction and Future Perspectives

Accounts of Materials Research
2025-03-05 | Journal article
DOI: 10.1021/accountsmr.4c00296
Contributors: Cheng Chen; Yiding Wang; Jie Hou; Jun Song
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Molecular dynamics simulations of interaction between a super edge dislocation and interstitial dislocation loops in irradiated L12-Ni3Al

Journal of Nuclear Materials
2025-02 | Journal article
DOI: 10.1016/j.jnucmat.2024.155541
Contributors: Cheng Chen; Dongyang Qin; Yiding Wang; Fei Xu; Jun Song
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Crossref

Ph3pyWF: An automated workflow software package for ceramic lattice thermal conductivity calculation

Computer Physics Communications
2025-02 | Journal article
DOI: 10.1016/j.cpc.2024.109441
Contributors: Yuxuan Wang; Kerui Lai; Guoqiang Lan; Jun Song
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Vacancy patterns in nitride precipitates and implication to hydrogen trapping and diffusion in high strength steels

Computational Materials Science
2025-02 | Journal article
DOI: 10.1016/j.commatsci.2024.113617
Contributors: Ziqi Cui; Xiaohan Bie; Jun Song
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Scandium-III-nitrides: A New Material Platform for Semiconductor Photocatalysts with High Reducing Power

Nano Letters
2025-01-15 | Journal article
DOI: 10.1021/acs.nanolett.4c05065
Contributors: Milad Fathabadi; Mohammad Fazel Vafadar; Siting Ni; Ying Zhao; Jun Song; Chao-Jun Li; Songrui Zhao
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Crossref

Understanding the influence of hydrogen on BCC iron grain boundaries using the kinetic activation relaxation technique (k-ART)

Journal of Physics: Materials
2025-01-13 | Journal article
DOI: 10.1088/2515-7639/ada9c3
Contributors: Aynour Khosravi; Jun Song; Normand Mousseau
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Understanding the influence of hydrogen on BCC iron grain boundaries using the kinetic activation relaxation technique (k-ART)

Journal of Physics: Materials
2025-01-01 | Journal article
DOI: 10.1088/2515-7639/ada994
Contributors: Aynour Khosravi; Jun Song; Normand Mousseau
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Understanding activation and growth of twin variants in polycrystalline magnesium under tension and compression: An atomistic study

Journal of Magnesium and Alloys
2024-12 | Journal article
DOI: 10.1016/j.jma.2024.12.007
Contributors: Huicong Chen; Cheng Chen; Jun Song; Stephen Yue
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Study of Lithium Transport in NMC Layered Oxide Cathode Material Using Multiscale Computational Approach

ACS Applied Energy Materials
2024-09-23 | Journal article
DOI: 10.1021/acsaem.4c01113
Contributors: Ali Jaberi; Michel L. Trudeau; Jun Song; Raynald Gauvin
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Deuterium trapping and desorption by vacancy clusters in irradiated Mo from object kinetic Monte Carlo simulations

Acta Materialia
2024-08 | Journal article
DOI: 10.1016/j.actamat.2024.120014
Contributors: Jie Hou; Xiangshan Kong; Wangyu Hu; Huiqiu Deng; Duc Nguyen-Manh; Jun Song
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Sub-stoichiometry and vacancy structures in V/Nb carbide precipitates by cluster expansion and first-principles calculations

Acta Materialia
2024-05 | Journal article
DOI: 10.1016/j.actamat.2024.119806
Contributors: Xiaohan Bie; Jie Hou; Xiao Zhou; Jun Song
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Crossref

Critical assessment of hydrogen pipe diffusion at dislocations in metals

Acta Materialia
2024-04 | Journal article
DOI: 10.1016/j.actamat.2024.119758
Contributors: Xiao Zhou; Pengfei Ou; Normand Mousseau; Jun Song
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Crossref

Planar fault transformation and unfaulting of interstitial dislocation loops in irradiated L12-Ni3Al

Scripta Materialia
2024-03 | Journal article
DOI: 10.1016/j.scriptamat.2023.115898
Contributors: Cheng Chen; Fanchao Meng; Jun Song
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Study of lithium transport in Li2O component of the solid electrolyte interphase in lithium-ion batteries

Computational Materials Science
2024-03 | Journal article
DOI: 10.1016/j.commatsci.2024.112914
Contributors: Ali Jaberi; Jun Song; Raynald Gauvin
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Basal plane activation of two-dimensional transition metal dichalcogenidesviaalloying for the hydrogen evolution reaction: first-principles calculations and machine learning prediction

Journal of Materials Chemistry A
2023 | Journal article
DOI: 10.1039/D3TA01361H
Contributors: Yiqing Chen; Ying Zhao; Pengfei Ou; Jun Song
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Photocatalytic syngas production from bio-derived glycerol and water on AuIn-decorated GaN nanowires supported by Si wafer

Green Chemistry
2023 | Journal article
DOI: 10.1039/D2GC04107C
Contributors: Zhouzhou Wang; Bowen Sheng; Yiqing Chen; Sharif Md. Sadaf; Jinglin Li; Jiajia Yang; Jun Song; Lin Yao; Ying Yu; Lei Zhu et al.
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Two-dimensional III-nitride alloys: electronic and chemical properties of monolayer Ga(1−x)AlxN

Physical Chemistry Chemical Physics
2023 | Journal article
DOI: 10.1039/D3CP03291D
Contributors: Yiqing Chen; Ying Zhao; Pengfei Ou; Jun Song
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Crossref

Basal Plane Activation via Grain Boundaries in Monolayer MoS2 for Carbon Dioxide Reduction

ACS Catalysis
2023-10-06 | Journal article
DOI: 10.1021/acscatal.3c03113
Contributors: Ying Zhao; Yiqing Chen; Pengfei Ou; Jun Song
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Crossref

Nickel–Iron Bimetal as a Cost-Effective Cocatalyst for Light-Driven Hydrogen Release from Methanol and Water

ACS Catalysis
2023-08-04 | Journal article
DOI: 10.1021/acscatal.3c02024
Contributors: Jinglin Li; Bowen Sheng; Yiqing Chen; Jiajia Yang; Tao Ma; Chang You; Yixin Li; Tianqi Yu; Jun Song; Hu Pan et al.
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Crossref

Air-promoted light-driven hydrogen production from bioethanol over core/shell CrOx@GaN nanoarchitecture

2023-07-19 | Preprint
DOI: 10.21203/rs.3.rs-3048542/v1
Contributors: BAOWEN ZHOU; Zhouzhou Wang; Yiqing Chen; Bowen Sheng; Jinglin Li; Lin Yao; Ying Yu; Jun Song; Tianqi Yu; Yixin Li et al.
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Crossref

Epitaxial hexagonal boron nitride with high quantum efficiency

APL Materials
2023-05-01 | Journal article
DOI: 10.1063/5.0142242
Contributors: David Arto Laleyan; Woncheol Lee; Ying Zhao; Yuanpeng Wu; Ping Wang; Jun Song; Emmanouil Kioupakis; Zetian Mi
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Crossref

Computational assessment of solute segregation at twin boundaries in magnesium: A two-factor model and solute effect on strengthening

Journal of Applied Physics
2022-12-14 | Journal article
DOI: 10.1063/5.0127266
Contributors: Huicong Chen; Jun Song
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Crossref

Oxynitride-surface engineering of rhodium-decorated gallium nitride for efficient thermocatalytic hydrogenation of carbon dioxide to carbon monoxide

Communications Chemistry
2022-09-06 | Journal article
DOI: 10.1038/s42004-022-00728-x
Contributors: Jinglin Li; Bowen Sheng; Yiqing Chen; Sharif Md. Sadaf; Jiajia Yang; Ping Wang; Hu Pan; Tao Ma; Lei Zhu; Jun Song et al.
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Efficient photoelectrochemical conversion of CO2 to syngas by photocathode engineering

Green Energy & Environment
2022-06 | Journal article
DOI: 10.1016/j.gee.2020.11.015
Contributors: Sheng Chu; Pengfei Ou; Roksana Tonny Rashid; Yuyang Pan; Daolun Liang; Huiyan Zhang; Jun Song
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Crossref

Design of Ru-Ni diatomic sites for efficient alkaline hydrogen oxidation

Science Advances
2022-06-03 | Journal article
DOI: 10.1126/sciadv.abm3779
Contributors: Lili Han; Pengfei Ou; Wei Liu; Xiang Wang; Hsiao-Tsu Wang; Rui Zhang; Chih-Wen Pao; Xijun Liu; Way-Faung Pong; Jun Song et al.
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A Combined Atomistic-Continuum Study on the Unfaulting of Single and Multi-layer Interstitial Dislocation Loops in Irradiated FCC and HCP Metals

International Journal of Plasticity
2022-05 | Journal article
DOI: 10.1016/j.ijplas.2022.103231
Contributors: Cheng Chen; Jun Song
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Crossref

Atomistic and continuum modeling of 3D graphene honeycombs under uniaxial in-plane compression

Computational Materials Science
2021-09 | Journal article
DOI: 10.1016/j.commatsci.2021.110646
Contributors: Yiqing Chen; Fanchao Meng; Xiaohan Bie; Pengfei Ou; Jun Song
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Crossref

Accurate prediction of vacancy cluster structures and energetics in bcc transition metals

Acta Materialia
2021-06 | Journal article
DOI: 10.1016/j.actamat.2021.116860
Contributors: Jie Hou; Yu-Wei You; Xiang-Shan Kong; Jun Song; C.S. Liu
Source: check_circle
Crossref

Comprehensive study of vacancy frank loop unfaulting: atomistic simulations and predictive model

Acta Materialia
2021-04 | Journal article
DOI: 10.1016/j.actamat.2021.116745
Contributors: Cheng Chen; Jing Zhang; Jun Song
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Crossref

Negative Poisson's ratio in graphene Miura origami

Mechanics of Materials
2021-04 | Journal article
DOI: 10.1016/j.mechmat.2021.103774
Contributors: Fanchao Meng; Shuying Chen; Wenyan Zhang; Pengfei Ou; Jing Zhang; Cheng Chen; Jun Song
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Crossref

Basal plane activation in monolayer MoTe2 for the hydrogen evolution reaction via phase boundaries

Journal of Materials Chemistry A
2020 | Journal article
DOI: 10.1039/D0TA06165D
Contributors: Yiqing Chen; Pengfei Ou; Xiaohan Bie; Jun Song
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Crossref

Hydrogen clustering in bcc metals: Atomic origin and strong stress anisotropy

Acta Materialia
2020-12 | Journal article
DOI: 10.1016/j.actamat.2020.09.048
Contributors: Jie Hou; Xiang-Shan Kong; C.S. Liu; Jun Song
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Crossref

Selective Crystal Growth Regulation by Chiral α-Hydroxycarboxylic Acids Improves the Strength and Toughness of Calcium Sulfate Cements

ACS Applied Bio Materials
2020-12-21 | Journal article
DOI: 10.1021/acsabm.0c00918
Contributors: Hanan Moussa; Wenge Jiang; Amir El Hadad; Ammar A. Alsheghri; Tayebeh Basiri; Doaa Taqi; Jun Song; Faleh Tamimi
Source: check_circle
Crossref

Electrosynthesis of Ammonia Using Porous Bimetallic Pd–Ag Nanocatalysts in Liquid- and Gas-Phase Systems

ACS Catalysis
2020-09-04 | Journal article
DOI: 10.1021/acscatal.0c02680
Contributors: Mohammadreza Nazemi; Pengfei Ou; Abdulaziz Alabbady; Luke Soule; Alan Liu; Jun Song; Todd A. Sulchek; Meilin Liu; Mostafa A. El-Sayed
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Crossref

Basal Plane Activation in Monolayer MoTe2 for Hydrogen Evolution Reaction via Phase Boundaries

2020-06-19 | Preprint
DOI: 10.26434/chemrxiv.12501281.v1
Contributors: Yiqing Chen; Pengfei Ou; Xiaohan Bie; Jun Song
Source: check_circle
Crossref

Basal Plane Activation in Monolayer MoTe2 for Hydrogen Evolution Reaction via Phase Boundaries

2020-06-19 | Preprint
DOI: 10.26434/chemrxiv.12501281
Contributors: Yiqing Chen; Pengfei Ou; Xiaohan Bie; Jun Song
Source: check_circle
Crossref

High strength brushite bioceramics obtained by selective regulation of crystal growth with chiral biomolecules

Acta Biomaterialia
2020-04 | Journal article
DOI: 10.1016/j.actbio.2020.01.047
Contributors: Hanan Moussa; Wenge Jiang; Ammar Alsheghri; Alaa Mansour; Amir El Hadad; Haihua Pan; Ruikang Tang; Jun Song; Javier Vargas; Marc D. McKee et al.
Source: check_circle
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Unveiling the mechanism of improved capacity retention in Pmn21 Li2FeSiO4 cathode by cobalt substitution

Journal of Materials Chemistry A
2019 | Journal article
DOI: 10.1039/C9TA10287F
Contributors: Yan Zeng; Hsien-Chieh Chiu; Bin Ouyang; Jun Song; Karim Zaghib; George P. Demopoulos
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Simultaneous Enhancement of Near-Infrared Emission and Dye Photodegradation in a Racemic Aspartic Acid Compound via Metal-Ion Modification

ACS Omega
2019-11-19 | Journal article
DOI: 10.1021/acsomega.9b02434
Contributors: Ye Wu; Pengfei Ou; Frank R. Fronczek; Jun Song; Yingcheng Lin; Hui-Min Wen; Jian Xu
Source: check_circle
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Predictive model of hydrogen trapping and bubbling in nanovoids in bcc metals

Nature Materials
2019-08 | Journal article
DOI: 10.1038/s41563-019-0422-4
Contributors: Jie Hou; Xiang-Shan Kong; Xuebang Wu; Jun Song; C. S. Liu
Source: check_circle
Crossref

Photoelectrochemical CO2 Reduction into Syngas with the Metal/Oxide Interface

Journal of the American Chemical Society
2018-06-27 | Journal article
DOI: 10.1021/jacs.8b03067
Contributors: Sheng Chu; Pengfei Ou; Pegah Ghamari; Srinivas Vanka; Baowen Zhou; Ishiang Shih; Jun Song; Zetian Mi
Source: check_circle
Crossref

Multilayer SnSb4–SbSe Thin Films for Phase Change Materials Possessing Ultrafast Phase Change Speed and Enhanced Stability

ACS Applied Materials & Interfaces
2017-08-16 | Journal article
DOI: 10.1021/acsami.7b06533
Contributors: Ruirui Liu; Xiao Zhou; Jiwei Zhai; Jun Song; Pengzhi Wu; Tianshu Lai; Sannian Song; Zhitang Song
Source: check_circle
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Peer review (21 reviews for 12 publications/grants)

Review activity for ACS applied nano materials. (1)
Review activity for ACS omega. (2)
Review activity for ACS sustainable chemistry & engineering. (1)
Review activity for Acta materialia. (5)
Review activity for Advanced theory and simulations. (1)
Review activity for Communications materials. (1)
Review activity for International journal of hydrogen energy. (1)
Review activity for Journal of Materials Research and Technology. (1)
Review activity for Journal of physical chemistry. (2)
Review activity for Materials today communications. (1)
Review activity for Scripta materialia. (4)
Review activity for The journal of physical chemistry. (1)
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