4 papers
Equation of state for shock-compressed porous molybdenum from first-principles mean-field potential calculations
Qili Zhang, Ping Zhang, Gongmu Zhang +1
The Hugoniot curves for shock-compressed molybdenum with initial porosities of 1.0, 1.26, 1.83, and 2.31 are theoretically investigated. The method of calculations combines the fir…
Mean-field potential calculations of high-pressure equation of state for shock-compressed BeO
Qili Zhang, Ping Zhang, Haifeng Song +1
A systematic study of the Hugoniot equation of state, phase transition, and the other thermodynamic properties including the Hugoniot temperature, the electronic and ionic heat cap…
First-Principles calculation of atomic hydrogen adsorption on Be(10\={1}0) thin films
Ping Zhang, Hong-Zhou Song
We present a first-principles study of the atomic hydrogen adsorption onto the Be(10\={1}0) thin film. There are two types of Be(10\={1}0) surfaces according to the interlayer spac…
First-Principles Calculation of Be(0001) Thin Films: Quantum Size Effect and Adsorption of Atomic Hydrogen
Ping Zhang, Hong-Zhou Song
We have carried out first-principles calculations of Be(0001) thin films to study the oscillatory quantum size effects exhibited in the surface energy, work function, and binding e…