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Thermodynamic stability and structure of cuprous chloride surfaces: a DFT investigation

Water-induced, spin-dependent defects on the silicon (001) surface

Density functional study of the Ge(111)c(2 x 8) surface using the modified Becke-Johnson exchange potential with LDA correlation and spin-orbit interactions

Initial Stages of Oxygen Chemisorption on the Ge(001) Surface

Interaction of acetone with the Ge(001) surface

Surface electronic structure calculations using the MBJLDA potential: application to Si(111) 2 3 1

Water formation via HCl oxidation on Cu(100)

An improved density functional theory description of the Ge(100)c(4 x 2) surface using the MBJLDA xc potential and spin-orbit interactions

Guided self-assembly of metal atoms on silicon using organic-molecule templating

Slab thickness effects for the clean and adsorbed Ge(001) surface with comparison to Si(001)

An equilibrium ab initio atomistic thermodynamics study of chlorine adsorption on the Cu(001) surface

Chlorination of the Cu(110) surface and copper nanoparticles: a density functional theory study

Dimer pinning and the assignment of semiconductor-adsorbate surface structures

Adsorption of 2-chlorophenol on Cu₂O(1 1 1)–CuCUS: a first-principles density functional study

Comment on "Transformation of C-type defects on Si (1 0 0) - 2 x 1 surface at room temperature STM/STS study [Surf. Sci. 602 (2008) 2835]"

Interaction of chlorine and oxygen with the Cu(100) surface

A first-principles density functional study of chlorophenol adsorption on Cu₂O(110):CuO

Acetone on silicon (001): ambiphilic molecule meets ambiphilic surface

Carbonyl mediated attachment to silicon: acetaldehyde on Si(001)

Norbornadiene-based molecules for functionalizing the Si(001) surface

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