544 citations · 679 across the 7 of their papers we have counts for
8 papers
Interference effects in one-dimensional moiré crystals
Nils Wittemeier, Matthieu J. Verstraete, Pablo Ordejón +1
Interference effects in finite sections of one-dimensional moiré crystals are investigated using a Landauer-Büttiker formalism within the tight-binding approximation. We explain in…
Electron-hole response function of transition metal trichalcogenides NbSe and monoclinic-TaS
Bogdan Guster, Miguel Pruneda, Pablo Ordejón +2
NbSe and monoclinic-TaS (-TaS) are quasi-1D metals containing three different types of chains and undergoing two different charge density wave (CDW) Peierls transiti…
SIESTA: recent developments and applications
Alberto García, Nick Papior, Arsalan Akhtar +33
A review of the present status, recent enhancements, and applicability of the SIESTA program is presented. Since its debut in the mid-nineties, SIESTA's flexibility, efficiency and…
Dielectric screening in extended systems using the self-consistent Sternheimer equation and localized basis sets
Hannes Hübener, Miguel A. Pérez-Osorio, Pablo Ordejón +1
We develop a first-principles computational method for investigating the dielectric screening in extended systems using the self-consistent Sternheimer equation and localized non-o…
Band bending and quasi-2DEG in the metallized -SiC(001) surface
R. Rurali, E. Wachowicz, P. Hyldgaard +1
We study the mechanism leading to the metallization of the -SiC(001) Si-rich surface induced by hydrogen adsorption. We analyze the effects of band bending and demonstrate the e…
Hydrogen-induced metallization of the -SiC(001) Si-rich surface
R. Rurali, E. Wachowicz, P. Hyldgaard +1
This paper has been withdrawn by the authors (see text).