Development of interatomic potentials appropriate for simulation of devitrification of Al90Sm10 alloy MI Mendelev, F Zhang, Z Ye, Y Sun, MC Nguyen, SR Wilson, CZ Wang, ... Modelling and Simulation in Materials Science and Engineering 23 (4), 045013, 2015 | 78 | 2015 |
Development of a semi-empirical potential suitable for molecular dynamics simulation of vitrification in Cu-Zr alloys MI Mendelev, Y Sun, F Zhang, CZ Wang, KM Ho The Journal of Chemical Physics 151 (21), 214502, 2019 | 77 | 2019 |
Temperature-dependent structure evolution in liquid gallium LH Xiong, XD Wang, Q Yu, H Zhang, F Zhang, Y Sun, QP Cao, HL Xie, ... Acta Materialia 128, 304-312, 2017 | 73 | 2017 |
Overcoming the time limitation in Molecular Dynamics simulation of crystal nucleation: a persistent-embryo approach Y Sun, H Song, F Zhang, L Yang, Z Ye, MI Mendelev, CZ Wang, KM Ho Physical Review Letters 120 (8), 085703, 2018 | 68 | 2018 |
Calculations of energy-loss function for 26 materials Y Sun, H Xu, B Da, S Mao, Z Ding Chinese Journal of Chemical Physics 29 (6), 663-670, 2016 | 61 | 2016 |
Fundamental Link between β Relaxation, Excess Wing, and Cage-Breaking in Metallic Glasses HB Yu, M Yang, Y Sun, F Zhang, JB Liu, C Wang, K Ho, R Richert, ... The Journal of Physical Chemistry Letters 9 (19), 5877-5883, 2018 | 59 | 2018 |
Development of a deep machine learning interatomic potential for metalloid-containing Pd-Si compounds T Wen, CZ Wang, MJ Kramer, Y Sun, B Ye, H Wang, X Liu, C Zhang, ... Physical Review B 100 (17), 174101, 2019 | 58 | 2019 |
Cooling rate dependence of structural order in Al90Sm10 metallic glass Y Sun, Y Zhang, F Zhang, Z Ye, Z Ding, CZ Wang, KM Ho Journal of Applied Physics 120 (1), 015901, 2016 | 52 | 2016 |
‘Crystal Genes’ in Metallic Liquids and Glasses Y Sun, F Zhang, Z Ye, Y Zhang, X Fang, Z Ding, CZ Wang, MI Mendelev, ... Scientific Reports 6, 23734, 2016 | 51 | 2016 |
A reverse Monte Carlo method for deriving optical constants of solids from reflection electron energy-loss spectroscopy spectra B Da, Y Sun, SF Mao, ZM Zhang, H Jin, H Yoshikawa, S Tanuma, ZJ Ding Journal of Applied Physics 113 (21), 214303, 2013 | 50 | 2013 |
Predicting Complex Relaxation Processes in Metallic Glass Y Sun, SX Peng, Q Yang, F Zhang, MH Yang, CZ Wang, KM Ho, HB Yu Physical Review Letters 123 (10), 105701, 2019 | 43 | 2019 |
Topochemical Deintercalation of Li from Layered LiNiB: toward 2D MBene G Bhaskar, V Gvozdetskyi, M Batuk, KM Wiaderek, Y Sun, R Wang, ... Journal of the American Chemical Society 143 (11), 4213-4223, 2021 | 38 | 2021 |
Effect of nitrogen doping and pressure on the stability of Y Sun, F Zhang, S Wu, V Antropov, KM Ho Physical Review B 108 (2), L020101, 2023 | 33 | 2023 |
Molecular dynamics simulation of the solid-liquid interface migration in terbium MI Mendelev, F Zhang, H Song, Y Sun, CZ Wang, KM Ho The Journal of Chemical Physics 148 (21), 214705, 2018 | 32 | 2018 |
Nucleation of stoichiometric compounds from liquid: Role of the kinetic factor H Song, Y Sun, F Zhang, CZ Wang, KM Ho, MI Mendelev Physical Review Materials 2 (2), 023401, 2018 | 30 | 2018 |
Discovering rare-earth-free magnetic materials through the development of a database M Sakurai, R Wang, T Liao, C Zhang, H Sun, Y Sun, H Wang, X Zhao, ... Physical Review Materials 4 (11), 114408, 2020 | 28 | 2020 |
Local structure order in Pd78Cu6Si16 liquid GQ Yue, Y Zhang, Y Sun, B Shen, F Dong, ZY Wang, RJ Zhang, ... Scientific reports 5, 8277, 2015 | 27 | 2015 |
Structural hierarchy as a key to complex phase selection in Al-Sm Z Ye, F Zhang, Y Sun, MC Nguyen, SH Zhou, L Zhou, F Meng, RT Ott, ... Physical Review Materials 1 (5), 055601, 2017 | 26* | 2017 |
Composition-dependent stability of the medium-range order responsible for metallic glass formation F Zhang, M Ji, XW Fang, Y Sun, CZ Wang, MI Mendelev, MJ Kramer, ... Acta Materialia 81, 337-344, 2014 | 26 | 2014 |
Two-step nucleation of the Earth’s inner core Y Sun, F Zhang, MI Mendelev, RM Wentzcovitch, KM Ho Proceedings of the National Academy of Sciences 119 (2), e2113059119, 2022 | 25 | 2022 |