Abstract Effect of grain refinement on corrosion behavior of Mg–Pb-9.2 Al-0.8 B alloy by
equal-channel angular pressing (ECAP). By measuring open circuit potential (OCP) and …

In this work, the first-principles calculations were performed to discuss adsorption energies,
electronic structures, and phase diagrams of boron atoms adsorbed on a α-Ti (0001) surface …

The influence of O2 and H2O adsorption significantly affects the electrochemical corrosion of
the NiTi alloy, with unresolved corrosion disparities between the NiTi-B2 and NiTi-B19 …

Since defluorination is most likely to occur during the formation of polytetrafluoroethylene
(PTFE) transfer film, understanding the adsorption mechanism of defluorinated fluorine can …

The atomic morphology change in the NiCr alloy surface induced by fluorine-chemisorption
was investigated by the ab initio atomistic thermodynamic method to elucidate early-stage …

Adsorption energies, structural properties and electronic structures of atomic bromine
adsorbed in on-surface sites on Mg (0 0 0 1) surface were investigated by using the density …

To investigate the dissolution mechanism of Ti metal, ab initio calculations were conducted
to observe the impact of Ti vacancy defects on the O-adsorbed Ti (0001) surface, focusing …

The inhibition behavior of the promising eco-friendly inhibitor 8-hydroxyquinoline (8HQ) in
two concentrations of sodium chloride solution was studied by hydrogen evolution, scanning …

The adsorption energies, geometric structures, electronic properties, work functions and
surface dipole moments of monatomic Ag adsorption on the (2× 2) BiOCl (0 0 1) surfaces …

First-principles methods are applied to investigate the adsorption energy and electronic
structure of p (2× 2) configuration of chlorine atoms adsorbed in variety of sites of Mg (0 0 0 …