52 citations · 89 across the 5 of their papers we have counts for
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cond-mat.mtrl-sci2001★ 52 cited
ab inito local vibrational modes of light impurities in silicon
J. M. Pruneda, S. K. Estreicher, J. Junquera +2
We have developed a formulation of density functional perturbation theory for the calculation of vibrational frequencies in molecules and solids, which uses numerical atomic orbita…
cond-mat.mtrl-sci2001
Antiferromagnetic interlayer coupling in Fe/c-SiFe/Fe sandwiches and multilayers
J. M. Alonso Pruneda, R. Robles, S. Bouarab +2
We report the first ab-initio study of the interlayer exchange coupling in Fe/c-FeSi/Fe sandwiches and Fe/c-FeSi multilayers. We perform several structural studies, which show the…