Titre de série :	Topics in Current Chemistry
Titre :	Vol.347 : First principles approaches to spectroscopic properties of complex materials
Type de document :	texte imprimé
Auteurs :	Cristiana Di Valentin, Éditeur scientifique ; Silvana Botti, Éditeur scientifique ; Matteo Cococcioni, Éditeur scientifique
Editeur :	Berlin, Heidelberg : Springer
Année de publication :	2014
Collection :	Topics in Current Chemistry, ISSN 0340-1022 num. 347
Importance :	xii, 392 p.
Format :	24 cm
ISBN/ISSN/EAN :	978-3-642-55067-6
Langues :	Anglais (eng)
Note de contenu :	"* Electronic and optical properties of dye-sensitized TiO2 interfaces * Status in calculating electronic excited states in transition metal oxides from first principles * Quasiparticle self-consistent GW method for the spectral properties of complex materials * Gas-phase valence-electron photoemission spectroscopy using density functional theory * Piecewise linearity and spectroscopic properties from Koopmans-compliant functionals * Optical response of extended systems using time-dependent density functional theory * Spin excitations in solids from many-body perturbation theory * Dynamical mean field theory-based electronic structure calculations for correlated materials * Probing strongly correlated materials in non-equilibrium: Basic concepts and possible future trends in first principle approaches * The Bethe–Salpeter equation."
Cote :	EXCLU (SdL)
Num_Inv :	3275

Topics in Current Chemistry. Vol.347 : First principles approaches to spectroscopic properties of complex materials [texte imprimé] / Cristiana Di Valentin, Éditeur scientifique ; Silvana Botti, Éditeur scientifique ; Matteo Cococcioni, Éditeur scientifique . - Berlin, Heidelberg : Springer, 2014 . - xii, 392 p. ; 24 cm. - (Topics in Current Chemistry, ISSN 0340-1022; 347) .
ISBN : 978-3-642-55067-6
Langues : Anglais (eng)

Note de contenu :	"* Electronic and optical properties of dye-sensitized TiO2 interfaces * Status in calculating electronic excited states in transition metal oxides from first principles * Quasiparticle self-consistent GW method for the spectral properties of complex materials * Gas-phase valence-electron photoemission spectroscopy using density functional theory * Piecewise linearity and spectroscopic properties from Koopmans-compliant functionals * Optical response of extended systems using time-dependent density functional theory * Spin excitations in solids from many-body perturbation theory * Dynamical mean field theory-based electronic structure calculations for correlated materials * Probing strongly correlated materials in non-equilibrium: Basic concepts and possible future trends in first principle approaches * The Bethe–Salpeter equation."
Cote :	EXCLU (SdL)
Num_Inv :	3275