Cargando…

Quantal Density Functional Theory

This book deals with quantal density functional theory (QDFT) which is a time-dependent local effective potential theory of the electronic structure of matter. The treated time-independent QDFT constitutes a special case. In the 2nd edition, the theory is extended to include the presence of external...

Descripción completa

Detalles Bibliográficos
Clasificación:Libro Electrónico
Autor principal: Sahni, Viraht (Autor)
Autor Corporativo: SpringerLink (Online service)
Formato: Electrónico eBook
Idioma:Inglés
Publicado: Berlin, Heidelberg : Springer Berlin Heidelberg : Imprint: Springer, 2016.
Edición:2nd ed. 2016.
Temas:
Acceso en línea:Texto Completo

MARC

LEADER 00000nam a22000005i 4500
001 978-3-662-49842-2
003 DE-He213
005 20220120214018.0
007 cr nn 008mamaa
008 160812s2016 gw | s |||| 0|eng d
020 |a 9783662498422  |9 978-3-662-49842-2 
024 7 |a 10.1007/978-3-662-49842-2  |2 doi 
050 4 |a QC19.2-20.85 
072 7 |a PHU  |2 bicssc 
072 7 |a SCI040000  |2 bisacsh 
072 7 |a PHU  |2 thema 
082 0 4 |a 530.1  |2 23 
100 1 |a Sahni, Viraht.  |e author.  |4 aut  |4 http://id.loc.gov/vocabulary/relators/aut 
245 1 0 |a Quantal Density Functional Theory  |h [electronic resource] /  |c by Viraht Sahni. 
250 |a 2nd ed. 2016. 
264 1 |a Berlin, Heidelberg :  |b Springer Berlin Heidelberg :  |b Imprint: Springer,  |c 2016. 
300 |a XIX, 413 p. 71 illus., 20 illus. in color.  |b online resource. 
336 |a text  |b txt  |2 rdacontent 
337 |a computer  |b c  |2 rdamedia 
338 |a online resource  |b cr  |2 rdacarrier 
347 |a text file  |b PDF  |2 rda 
505 0 |a From the Contents: Schrödinger Theory from the Perspective of 'Classical' Fields Derived from Quantal Sources -- Quantal Density Functional Theory -- The Hohenberg-Kohn Theorems and Kohn-Sham Density Functional Theory -- Physical Interpretation of Kohn-Sham Density Functional Theory -- Generalization of the Hohenberg-Kohn Theorem to the Presence of a Magnetostatic Field. 
520 |a This book deals with quantal density functional theory (QDFT) which is a time-dependent local effective potential theory of the electronic structure of matter. The treated time-independent QDFT constitutes a special case. In the 2nd edition, the theory is extended to include the presence of external magnetostatic fields. The theory is a description of matter based on the 'quantal Newtonian' first and second laws which is in terms of "classical" fields that pervade all space, and their quantal sources. The fields, which are explicitly defined, are separately representative of electron correlations due to the Pauli exclusion principle, Coulomb repulsion, correlation-kinetic, correlation-current-density, and correlation-magnetic effects. The book further describes Schrödinger theory from the new physical perspective of fields and quantal sources. It also describes traditional Hohenberg-Kohn-Sham DFT, and explains via QDFT the physics underlying the various energy functionals and functional derivatives of the traditional approach to electronic structure. . 
650 0 |a Mathematical physics. 
650 0 |a Chemometrics. 
650 0 |a Surfaces (Physics). 
650 0 |a Surfaces (Technology). 
650 0 |a Thin films. 
650 1 4 |a Theoretical, Mathematical and Computational Physics. 
650 2 4 |a Mathematical Applications in Chemistry. 
650 2 4 |a Surface and Interface and Thin Film. 
650 2 4 |a Surfaces, Interfaces and Thin Film. 
710 2 |a SpringerLink (Online service) 
773 0 |t Springer Nature eBook 
776 0 8 |i Printed edition:  |z 9783662498408 
776 0 8 |i Printed edition:  |z 9783662498415 
776 0 8 |i Printed edition:  |z 9783662570395 
856 4 0 |u https://doi.uam.elogim.com/10.1007/978-3-662-49842-2  |z Texto Completo 
912 |a ZDB-2-PHA 
912 |a ZDB-2-SXP 
950 |a Physics and Astronomy (SpringerNature-11651) 
950 |a Physics and Astronomy (R0) (SpringerNature-43715)