Role of nonlocal exchange correlation in activated adsorption
- Autor
- HAMMER, B; JACOBSEN, K. W; NØRSKOV, J. K
Tech. univ. Denmark, physics dep., 2800 Lyngby, Denmark - Fuente
Physical review letters. 1993, Vol 70, Num 25, pp 3971-3974 ; ref : 24 ref
- CODEN
- PRLTAO
- ISSN
- 0031-9007
- Campo Científico
- Optics; Atomic molecular physics; Condensed state physics; Physics; Plasma physics
- Editor
- American Physical Society, Ridge, NY
- País de la publicación
- United States
- Tipo de documento
- Article
- Idioma
- English
- Palabra clave (fr)
- Adsorption Aluminium Approximation densité locale Densité charge Dissociation Energie totale Etude théorique Fonctionnelle densité Hauteur barrière Hydrogène Méthode ab initio Méthode gradient Pseudopotentiel Structure électronique Transfert charge Corrélation échange
- Palabra clave (in)
- Adsorption Aluminium Local density approximation Charge density Dissociation Total energy Theoretical study Density functional Barrier height Hydrogen Ab initio method Gradient method Pseudopotential Electronic structure Charge transfer
- Palabra clave (es)
- Adsorción Aluminio Aproximación densidad local Densidad carga Disociación Energía total Estudio teórico Funciónal densidad Altura barrera Hidrógeno Método ab initio Método gradiente Seudopotencial Estructura electrónica Transferencia carga
- Palabra clave (de)
- Adsorption Aluminium Ladungsdichte Dissoziation Theoretische Untersuchung Wasserstoff Pseudopotential Elektronenstruktur
- Clasificación
- Pascal
- 001 Exact sciences and technology / 001B Physics / 001B70 Condensed matter: electronic structure, electrical, magnetic, and optical properties / 001B70C Electronic structure and electrical properties of surfaces, interfaces, thin films and low-dimensional structures / 001B70C20 Surface and interface electron states
- Disciplina
- Metals. Metallurgy Physics of condensed state : electronic structure, electrical, magnetic and optical properties
- Procedencia
- Inist-CNRS
- Base de datos
- PASCAL
- Identificador INIST
- 4840159
Sauf mention contraire ci-dessus, le contenu de cette notice bibliographique peut être utilisé dans le cadre d’une licence CC BY 4.0 Inist-CNRS / Unless otherwise stated above, the content of this bibliographic record may be used under a CC BY 4.0 licence by Inist-CNRS / A menos que se haya señalado antes, el contenido de este registro bibliográfico puede ser utilizado al amparo de una licencia CC BY 4.0 Inist-CNRS
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DOI
10.1103/PhysRevLett.70.3971 
https://dx.doi.org/10.1103/PhysRevLett.70.3971
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