Hao Zhang
0000-0003-4080-3222
91 papers found
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Localization model description of diffusion and structural relaxation in superionic crystalline UO2
Bulk and surface properties of gypsum: A comparison between classical force fields and dispersion-corrected DFT calculations
Hydrogen inhibited phase transition near crack tip – An atomistic mechanism of hydrogen embrittlement
Superionic UO2: A model anharmonic crystalline material
Quantification of Temperature Dependence of Hydrogen Embrittlement in Pipeline Steel
Mechanistic Understanding and Nanomechanics of Multiple Hydrogen-Bonding Interactions in Aqueous Environment
Surface compressive and softening effect on deformation mode transition in Ni-Nb metallic glassy thin films: A molecular dynamics study
Study of Thermal Stability of Hydrotalcite and Carbon Dioxide Adsorption Behavior on Hydrotalcite-Derived Mixed Oxides Using Atomistic Simulations
Anisotropic Polymer Adsorption on Molybdenite Basal and Edge Surfaces and Interaction Mechanism With Air Bubbles
Self-Assembled Mesoporous Carbon Nitride with Tunable Texture for Enhanced Visible-Light Photocatalytic Hydrogen Evolution
Molecular Dynamics Study of the Role of Water in the Carbon Dioxide Intercalation in Chloride Ions Bearing Hydrotalcite
Anisotropic Deformation in the Compressions of Single Crystalline Copper Nanoparticles
Selective flotation separation of molybdenite and talc by humic substances
String-like collective motion and diffusion in the interfacial region of ice
Structural evolution and atomic dynamics in Ni–Nb metallic glasses: A molecular dynamics study
Probing interactions between sphalerite and hydrophobic/hydrophilic surfaces: Effect of water chemistry
Size effect on atomic structure in low-dimensional Cu-Zr amorphous systems
Temperature-dependent structure evolution in liquid gallium
Wetting at the nanoscale: A molecular dynamics study
Mapping the Nanoscale Heterogeneity of Surface Hydrophobicity on the Sphalerite Mineral
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