Ab initio study of ferroelectric domain walls in PbTiO3
Ab initio study of ferromagnetism induced by magnetic impurities in rutile TiO2
Ab initio Study of Graphene on SiC
Ab initio study of ladder-type polymers polythiophene and polypyrrole
Ab initio study of magnesium alanate, Mg(AlH4)2
Ab initio study of magnetic structure and chemical reactivity of Cr2O3 and its (0001) surface
Ab initio study of magnetism at the TiO2/LaAlO3 interface
Ab initio study of mirages and magnetic interactions in quantum corrals
Ab initio Study of Misfit Dislocations at the SiC/Si(001) Interface
Ab initio study of origin and properties of a metal-organic interface state of the PTCDA/Ag(111) system
Ab initio study of pressure stabilised NiTi allotropes: pressure-induced transformations and hysteresis loops
Ab initio study of proper topological ferroelectricity in layered perovskite La2Ti2O7
Ab initio study of reflectance anisotropy spectra of a sub-monolayer oxidized Si(100) surface
Ab Initio Study of Screw Dislocations in Mo and Ta: A new picture of plasticity in bcc transition metals
Ab initio study of semiconducting carbon nanotubes adsorbed on the Si(100) surface: diameter- and registration-dependent atomic configurations and electronic properties
Ab initio study of shock compressed oxygen
Ab initio study of single molecular transistor modulated by gate-bias
Ab initio study of spin-dependent transport in carbon nanotubes with iron and vanadium adatoms
Ab initio study of step formation and self-diffusion on Ag(100)
ab initio Study of Strain-Induced Ferroelectricity in SrTiO3