Lv5
960 积分 2024-01-30 加入
Cation vacancy engineering in medium-entropy NiFeCoZn layered double hydroxides electrocatalysts for boosting oxygen evolution reaction in water-splitting
1个月前
已完结
Nickel–vanadium monolayer double hydroxide for efficient electrochemical water oxidation
2个月前
已完结
Electron-energy-loss spectra and the structural stability of nickel oxide: An LSDA+U study
2个月前
已完结
Effect of the damping function in dispersion corrected density functional theory
2个月前
已完结
A consistent and accurateab initioparametrization of density functional dispersion correction (DFT-D) for the 94 elements H-Pu
2个月前
已完结
Generalized Gradient Approximation Made Simple
2个月前
已完结
Projector augmented-wave method
2个月前
已完结
From ultrasoft pseudopotentials to the projector augmented-wave method
2个月前
已完结
Efficient iterative schemes forab initiototal-energy calculations using a plane-wave basis set
2个月前
已完结
Ab‐initiosimulations of materials using VASP: Density‐functional theory and beyond
2个月前
已完结