Ab initio molecular-dynamics techniques extended to large-length-scale systems
- Author
- ARIAS, T. A1 ; PAYNE, M. C; JOANNOPOULOS, J. D
[1] MIT, physics dep., Cambridge MA 02139, United States - Source
Physical review. B, Condensed matter. 1992, Vol 45, Num 4, pp 1538-1549 ; ref : 25 ref
- CODEN
- PRBMDO
- ISSN
- 0163-1829
- Scientific domain
- Crystallography; Metallurgy, welding; Condensed state physics
- Publisher
- American Institute of Physics, Woodbury, NY
/
American Physical Society, Woodbury, NY
- Publication country
- United States
- Document type
- Article
- Language
- English
- Keyword (fr)
- Etude théorique Fonction corrélation Fonction onde Méthode ab initio Méthode dynamique moléculaire Méthode gradient conjugué Structure électronique
- Keyword (en)
- Theoretical study Correlation function Wave function Ab initio method Molecular dynamics method Conjugate gradient method Electronic structure
- Keyword (es)
- Estudio teórico Función correlación Función onda Método ab initio Método dinámico molecular Método gradiente conjugado Estructura electrónica
- Classification
- Pascal
- 001 Exact sciences and technology / 001B Physics / 001B70 Condensed matter: electronic structure, electrical, magnetic, and optical properties / 001B70A Electron states / 001B70A10 Theories and models of many electron systems
- Discipline
- Physics of condensed state : electronic structure, electrical, magnetic and optical properties
- Origin
- Inist-CNRS
- Database
- PASCAL
- INIST identifier
- 5170964
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/PhysRevB.45.1538 
https://dx.doi.org/10.1103/PhysRevB.45.1538
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