Surface segregation and chemical ordering patterns of Ag–Pd nanoalloys: energetic factors, nanoscale effects, and catalytic implication J Tang, L Deng, H Deng, S Xiao, X Zhang, W Hu The Journal of Physical Chemistry C 118 (48), 27850-27860, 2014 | 47 | 2014 |
Diffusion of Co, Ru and Re in Ni-based superalloys: a first-principles study X Zhang, H Deng, S Xiao, Z Zhang, J Tang, L Deng, W Hu Journal of alloys and compounds 588, 163-169, 2014 | 47 | 2014 |
Chemical Ordering and surface segregation in Cu–Pt nanoalloys: the synergetic roles in the formation of multishell structures J Tang, L Deng, S Xiao, H Deng, X Zhang, W Hu The Journal of Physical Chemistry C 119 (37), 21515-21527, 2015 | 42 | 2015 |
First-principles study of the binding preferences and diffusion behaviors of solutes in vanadium alloys L Deng, X Zhang, J Tang, H Deng, S Xiao, W Hu Journal of Alloys and Compounds 660, 55-61, 2016 | 37 | 2016 |
Atomistic simulations of solid solution strengthening in Ni-based superalloy X Zhang, H Deng, S Xiao, X Li, W Hu Computational materials science 68, 132-137, 2013 | 33 | 2013 |
Revealing the reaction mechanism of sodium selenide confined within a single-walled carbon nanotube: Implications for Na–Se batteries L Wang, X Zhang, L Deng, J Tang, H Deng, W Hu, Z Liu ACS applied materials & interfaces 11 (5), 4995-5002, 2019 | 30 | 2019 |
Orientation and grain-boundary dependence of shock-induced plasticity and transformation in nanocrystalline Ti L Wang, B Li, XL Deng, WR Jian, M Shang, L Deng, XM Zhang, JF Tang, ... Physical Review B 99 (17), 174103, 2019 | 25 | 2019 |
The effects of interstitial impurities on the mechanical properties of vanadium alloys: A first-principles study X Zhang, J Tang, L Deng, G Zhong, X Liu, Y Li, H Deng, W Hu Journal of Alloys and Compounds 701, 975-980, 2017 | 23 | 2017 |
Shock wave propagation, plasticity, and void collapse in open-cell nanoporous Ta JF Tang, JC Xiao, L Deng, W Li, XM Zhang, L Wang, SF Xiao, HQ Deng, ... Physical Chemistry Chemical Physics 20 (44), 28039-28048, 2018 | 21 | 2018 |
First-principles calculation of self-diffusion coefficients in Ni3Al X Zhang, H Deng, S Xiao, J Tang, L Deng, W Hu Journal of alloys and compounds 612, 361-364, 2014 | 21 | 2014 |
Effects of solute size on solid-solution hardening in vanadium alloys: a first-principles calculation X Zhang, J Tang, L Deng, H Deng, S Xiao, W Hu Scripta Materialia 100, 106-109, 2015 | 20 | 2015 |
Precipitate/vanadium interface and its strengthening on the vanadium alloys: A first-principles study X Zhang, Y Li, J Tang, L Deng, W Li, L Wang, H Deng, W Hu Journal of Nuclear Materials 527, 151821, 2019 | 19 | 2019 |
First-principles study on the dissolution and diffusion behavior of hydrogen in carbide precipitates Y Li, X Zhang, T Wu, J Tang, L Deng, W Li, L Wang, H Deng, W Hu International Journal of Hydrogen Energy 46 (42), 22030-22039, 2021 | 18 | 2021 |
Investigation of the interstitial oxygen behaviors in vanadium alloy: A first-principles study X Zhang, Y Li, Q He, R Li, L Deng, L Wang, X Liu, J Tang, H Deng, W Hu Current Applied Physics 18 (2), 183-190, 2018 | 17 | 2018 |
Atomistic simulation for the γ′-phase volume fraction dependence of the interfacial behavior of Ni-base superalloy X Yang, W Hu, X Zhang Applied surface science 264, 563-569, 2013 | 13 | 2013 |
Retention and diffusion of transmutation H and He atoms in Be 12 Ti: first-principles calculations X Zhu, C Wang, J Liu, X Zhang, H Deng, W Duan, L Yang RSC advances 8 (62), 35735-35743, 2018 | 12 | 2018 |
Ab initio solute–interstitial impurity interactions in vanadium alloys: the roles of vacancy L Deng, L Tang, X Zhang, J Tang, R Li, H Deng RSC advances 6 (82), 78621-78628, 2016 | 12 | 2016 |
Intrinsic strain-induced segregation in multiply twinned Cu–Pt icosahedra L Deng, X Liu, X Zhang, L Wang, W Li, M Song, J Tang, H Deng, S Xiao, ... Physical Chemistry Chemical Physics 21 (9), 4802-4809, 2019 | 11 | 2019 |
Local identification of chemical ordering: Extension, implementation, and application of the common neighbor analysis for binary systems L Deng, X Zhang, L Wang, J Tang, Z Liu, S Xiao, H Deng, W Hu Computational Materials Science 143, 195-205, 2018 | 11 | 2018 |
Influence of an exciton-delocalizing ligand on the structural, electronic, and spectral features of the Cd 33 S 33 quantum dot: insights from computational studies W Li, TF Lu, W Ren, L Deng, X Zhang, L Wang, J Tang, AE Kuznetsov Journal of Materials Chemistry C 6 (32), 8751-8761, 2018 | 11 | 2018 |