Search Results - subject:"linearized methods"

Structural, electronic and optical properties of SrCl<Subscript>2</Subscript> under hydrostatic stress

Benmimoun, Y.; Bouhemadou, A.; Khenata, R.; Reshak, A. H.; … - In: The European Physical Journal B - Condensed Matter and … 61 (2008) 2, pp. 165-171

The results of first-principles theoretical study of the structural, electronic and optical properties of SrCl<Subscript>2</Subscript> in its cubic structure, have been performed using the full-potential linear augmented plane-wave method plus local orbitals (FP-APW+lo) as implemented in the WIEN2k code. In this...</subscript>

Persistent link: https://www.econbiz.de/10009280048

Construction and solution of a Wannier-functions based Hamiltonian in the pseudopotential plane-wave framework for strongly correlated materials

Korotin, Dm.; Kozhevnikov, A.; Skornyakov, S.; Leonov, I.; … - In: The European Physical Journal B - Condensed Matter and … 65 (2008) 1, pp. 91-98

Persistent link: https://www.econbiz.de/10009281752

Martensitic phase transition from cubic to tetragonal V<Subscript>3</Subscript>Si: an electronic structure study

Paduani, C.; Kuhnen, C. A. - In: The European Physical Journal B - Condensed Matter and … 66 (2008) 3, pp. 353-359

Persistent link: https://www.econbiz.de/10009282961

Frontier induced semi-infinite-medium (FISIM) states at semiconductor surfaces and interfaces

Olguın, D.; Rodrıguez, J.A.; Baquero, R. - In: The European Physical Journal B - Condensed Matter and … 32 (2003) 1, pp. 119-126

Persistent link: https://www.econbiz.de/10009281604