Hong-Zhou Song

activity

20072022

most citedComparative study of first-principles approaches for effective Coulomb interaction strength

U_{eff}

between localized

f

-electrons: lanthanide metals as an example

21 citations · 22 across the 3 of their papers we have counts for

collaborators

Showing cond-mat.mtrl-sciShow all

3 papers · 1 filter

cond-mat.mtrl-sci2022★ 21 cited

Comparative study of first-principles approaches for effective Coulomb interaction strength $U_{eff}$ between localized $f$ -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…

cond-mat.mtrl-sci2021★ 1 cited

The underestimation of high pressure in DFT+ $U$ simulation for the wide range cold-pressure of lanthanide metals

Yue-Chao Wang, Bei-Lei Liu, Yu Liu +7

Density functional theory plus $U$ (DFT+ $U$ ) is one of the most efficient first-principles methods to simulate the cold pressure properties of strongly-correlated materials. Howeve…

cond-mat.mtrl-sci2007

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…

Comparative study of first-principles approaches for effective Coulomb interaction strength Ueff​ between localized f-electrons: lanthanide metals as an example

The underestimation of high pressure in DFT+U simulation for the wide range cold-pressure of lanthanide metals

First-Principles calculation of atomic hydrogen adsorption on Be(10\={1}0) thin films

Comparative study of first-principles approaches for effective Coulomb interaction strength $U_{eff}$ between localized $f$ -electrons: lanthanide metals as an example

The underestimation of high pressure in DFT+ $U$ simulation for the wide range cold-pressure of lanthanide metals