Chenyu Zou

Reactive Potentials for Advanced Atomistic Simulations

Tao Liang, Yun Kyung Shin, Yu‐Ting Cheng et al. · Annual Review of Materials Research · 2013 · 214 citations

Engineering, Physics, Natural Sciences +15

Molecular dynamics simulations of the effects of vacancies on nickel self-diffusion, oxygen diffusion and oxidation initiation in nickel, using the ReaxFF reactive force field

Chenyu Zou, Yun Kyung Shin, Adri C. T. van Duin et al. · Acta Materialia · 2014 · 117 citations · Full text

Materials Science, Molecular Dynamics, Engineering +14

Development and Validation of a ReaxFF Reactive Force Field for Fe/Al/Ni Alloys: Molecular Dynamics Study of Elastic Constants, Diffusion, and Segregation

Yun Kyung Shin, H. Shaun Kwak, Chenyu Zou et al. · The Journal of Physical Chemistry A · 2012 · 94 citations

Engineering, Mechanical Engineering, Material Simulation +19

Molecular Dynamics Investigation of the Effects of Tip–Substrate Interactions during Nanoindentation

Francesca Tavazza, Thomas P. Senftle, Chenyu Zou et al. · The Journal of Physical Chemistry C · 2015 · 83 citations

Engineering, Molecular Dynamics, Nanotribology +19

Interactions of hydrogen with the iron and iron carbide interfaces: a ReaxFF molecular dynamics study

Md Mahbubul Islam, Chenyu Zou, Adri C. T. van Duin et al. · Physical Chemistry Chemical Physics · 2015 · 81 citations