L.R. Zhao

Strategies for improving the sustainability of structural metals

Ab‐initiosimulations of materials using VASP: Density‐functional theory and beyond

A critical review of high entropy alloys and related concepts

Multiscale simulation of polycrystal mechanics of textured β‐Ti alloys using ab initio and crystal‐based finite element methods

Cemented carbide microstructures: a review

Response of trialuminides to [110] uniaxial loading: Anab initiostudy forAl3(Sc,Ti,V)

Overview of constitutive laws, kinematics, homogenization and multiscale methods in crystal plasticity finite-element modeling: Theory, experiments, applications

Phase stability in high entropy alloys: Formation of solid-solution phase or amorphous phase

Ab initiocalculations of elastic properties of isotropic and oriented Ti_1−xAl_xN hard coatings

Efficient stochastic generation of special quasirandom structures

Elastic properties, thermal expansion coefficients and electronic structures of Ti0.75X0.25C carbides

The synergistic action and interplay of hydrogen embrittlement mechanisms in steels and iron: Localized plasticity and decohesion

A comparison of polycrystalline elastic properties computed by analytic homogenization schemes and FEM

Error propagation in multiscale approaches to the elasticity of polycrystals

Microstructure and mechanical properties of WC Ni–Si based cemented carbides developed by powder metallurgy

Using Ab Initio Calculations in Designing bcc MgLi–X Alloys for Ultra‐Lightweight Applications

Ab initioelastic tensor of cubic Ti0.5Al0.5N alloys: Dependence of elastic constants on size and shape of the supercell model and their convergence

Modeling hardness of polycrystalline materials and bulk metallic glasses

Using ab initio calculations in designing bcc Mg–Li alloys for ultra-lightweight applications

Methodological challenges in combining quantum-mechanical and continuum approaches for materials science applications

Structural and mechanical properties of multi-element (AlCrMoTaTiZr)Nx coatings by reactive magnetron sputtering

Wear resistant TiMoN coatings deposited by magnetron sputtering

Ab initio study of elastic properties of Ir and Ir3X compounds

Elastic properties of platinum Rh and Rh3X compounds

Application of bond order in solid solution strengthening of nickel

Alloying effects on elastic properties of TiN-based nitrides