21 citations · 46 across the 5 of their papers we have counts for
3 papers · 1 filter
Comparative study of first-principles approaches for effective Coulomb interaction strength between localized -electrons: lanthanide metals as an example
Bei-Lei Liu, Yue-Chao Wang, Yu Liu +6
As correlation strength has a key influence on the simulation of strongly correlated materials, many approaches have been proposed to obtain the parameter using first-principles ca…
Novel Valence Transition in Elemental Metal Europium around 80 GPa
Bijuan Chen, Mingfeng Tian, Jurong Zhang +20
Valence transition could induce structural, insulator-metal, nonmagnetic-magnetic and superconducting transitions in rare-earth metals and compounds, while the underlying physics r…
Melting curve of magnesium up to 460 GPa from ab initio molecular dynamics simulations
Chengfeng Cui, Jiawei Xian, Haifeng Liu +3
Based on ab initio molecular dynamics simulations, we determined the melting curve of magnesium (Mg) up to ~460 GPa using the solid-liquid coexistence method. Between ~30 and 100 G…