Structure and dynamics of liquid lithium : comparison of ab initio molecular dynamics predictions with scattering experiments
- Author
- ANTA, J. A1 ; MADDEN, P. A1
[1] Physical and Theoretical Chemistry Laboratory, Oxford University, South Parks Road, Oxford OX1 3QZ, United Kingdom - Source
Journal of physics. Condensed matter (Print). 1999, Vol 11, Num 32, pp 6099-6111 ; ref : 32 ref
- CODEN
- JCOMEL
- ISSN
- 0953-8984
- Scientific domain
- Crystallography; Metallurgy, welding; Condensed state physics
- Publisher
- Institute of Physics, Bristol
- Publication country
- United Kingdom
- Document type
- Article
- Language
- English
- Keyword (fr)
- Calcul ab initio Calcul dynamique moléculaire Dynamique réticulaire Déplacement quadratique moyen Effet température Etude théorique Facteur structure dynamique Facteur structure Fonction autocorrélation Interaction ionique Interaction électron ion Méthode pseudopotentiel Structure état liquide
- Keyword (en)
- Ab initio calculations Molecular dynamics calculations Lattice dynamics Root mean square displacement Temperature effects Theoretical study Dynamic structure factor Structure factors Autocorrelation function Ionic interaction Electron ion interaction Pseudopotential methods Liquid structure
- Keyword (es)
- Desplazamiento cuadrático medio Factor estructura dinámica Función autocorrelación Interacción iónica Interacción electrón ión
- Classification
- Pascal
- 001 Exact sciences and technology / 001B Physics / 001B60 Condensed matter: structure, mechanical and thermal properties / 001B60A Structure of solids and liquids; crystallography / 001B60A20 Structure of liquids / 001B60A20J Computer simulation of liquid structure
- Pascal
- 001 Exact sciences and technology / 001B Physics / 001B60 Condensed matter: structure, mechanical and thermal properties / 001B60C Lattice dynamics / 001B60C50 Vibrational states in disordered systems
- Discipline
- Physics of condensed state : structure, mechanical and thermal properties
- Origin
- Inist-CNRS
- Database
- PASCAL
- INIST identifier
- 1881518
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
10.1088/0953-8984/11/32/302 
https://dx.doi.org/10.1088/0953-8984/11/32/302
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