Bo Wu

Unusual Ordering Behavior of Co3al-Based Γ′ Phase with L12 Structure Predicted by the Thermodynamic Model with Support of First-Principles Calculations

Cuilian Wen, H. Ali, Qiufang Cai, 2022, SSRN Electronic Journal.

A general approach to simulate the atom distribution, lattice distortion, and mechanical properties of multi-principal element alloys based on site preference: using FCC_CoNiV and CoCrNi to demonstrate and compare

Cuilian Wen, Qiufang Cai, Mao-hua Lin, 2022, Journal of Alloys and Compounds.

Balanced design for the feasible super rocket fuels: A first-principle study on gauche CHN7 and CHN3.

Tao Yu, Chi-Tay Tsai, Maohua Lin, 2018, Journal of molecular graphics & modelling.

Pressure-induced structure, electronic, thermodynamic and mechanical properties of Ti2AlNb orthorhombic phase by first-principles calculations

Zhenyi Wei, K. Hu, B. Sa, 2017, Rare Metals.

Prediction of the catalytic mechanism of hydrogen evolution reaction enhanced by surface oxidation on FCC_CoCrFeNi and Co0.35Cr0.15Fe0.2Mo0.1Ni0.2 multi-principal element alloys based on site preference

Rong Chen, Tianliang Xie, Liangji Weng, 2024, Applied Surface Science.

The preferred adsorption sites and catalytic mechanism of FCC_CoFeGaNiZn multi-principal element alloy for oxygen evolution reaction catalysis based on site preference of constituent atom on sublattice

Yan Zhao, Rong Chen, Liangji Weng, 2024, Intermetallics.