Physics – Condensed Matter – Materials Science
Scientist
Physics
Condensed Matter
Materials Science
Scientist
Accurate construction of transition metal pseudopotentials
Adsorbate-adsorbate interactions and chemisorption at different coverage studied by accurate {\em ab initio} calculations: CO on transition metal surfaces
CO on Pt(111) puzzle; A possible solution
First-principles extrapolation method for accurate CO adsorption energies on metal surfaces
Lattice normal modes and electronic properties of the correlated metal LaNiO$_3$
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