Tao Gao

Ab initio calculations of elastic constants and thermodynamic properties of NiAl under high pressures

Hongzhi Fu, Dehua Li, Feng Peng et al. · Computational Materials Science · 2008 · 419 citations

Materials Science, Thermodynamic Modelling, Elastic Constants +8

Stable Calcium Nitrides at Ambient and High Pressures

Shuangshuang Zhu, Feng Peng, Hanyu Liu et al. · Inorganic Chemistry · 2016 · 108 citations · Full text

Materials Science, Inorganic Chemistry, Chemical Engineering +13

Intermolecular friction symbol derived from crystal information

Chaoyang Zhang, Xianggui Xue, Yaofeng Cao et al. · CrystEngComm · 2013 · 83 citations

Materials Science, Molecular Solid, Nanotribology +12

Swelling of K⁺, Na⁺and Ca²⁺-montmorillonites and hydration of interlayer cations: a molecular dynamics simulation

Tao Liu, Xiaofeng Tian, Yu Zhao et al. · Chinese Physics B · 2010 · 77 citations

Ab initio study of structural, dielectric, and dynamical properties of zinc-blende ZnX (X=O, S, Se, Te)

You Yu, Jingjing Zhou, Huilei Han et al. · Journal of Alloys and Compounds · 2008 · 76 citations

Materials Science, Ii-vi Semiconductor, Dynamical Properties +8