Physics – Condensed Matter – Materials Science
Scientist
Physics
Condensed Matter
Materials Science
Scientist
Technical University of Denmark, Lyngby, Denmark
Department of Physics, Technical University of Denmark
A real-space grid implementation of the Projector Augmented Wave method
Ab initio van der Waals interactions in simulations of water alter structure from mainly tetrahedral to high-density-like
Ab-initio non-equilibrium quantum transport and forces with the real space projector augmented wave method
An Effective-Medium Tight-Binding Model for Silicon
Anomalous Conductance Oscillations and Half-Metallicity in Atomic Ag-O Chains
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