43 citations · 72 across the 7 of their papers we have counts for
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cond-mat.mtrl-sci2023★ 1 cited
Ab initio machine-learning unveils strong anharmonicity in non-Arrhenius self-diffusion of tungsten
Xi Zhang, Sergiy V. Divinski, Blazej Grabowski
We propose an efficient ab initio framework to compute the Gibbs energy of the transition state in vacancy-mediated diffusion including the relevant thermal excitations at density-…
cond-mat.mtrl-sci2023★ 12 cited
Structure and mechanical properties of monolayer amorphous carbon and boron nitride
Xi Zhang, Yu-Tian Zhang, Yun-Peng Wang +4
Amorphous materials exhibit various characteristics that are not featured by crystals and can sometimes be tuned by their degree of disorder (DOD). Here, we report results on the m…