Molecular dynamics simulation study of a hydronium ion in liquid water with implementation of the proton transfer by means of a hopping mechanism
- Author
- SCHMIDT, R. G; BRICKMANN, J
Tech. Hochschule Darmstadt, Inst. Physikalische Chemie I, 64287 Darmstadt, Germany - Conference title
- SSPC VII : solid state protonic conductors. International conference
- Conference name
- SSPC VII : solid state protonic conductors. International conference (7 ; Schwäbisch Gmünd 1994-08-29)
- Author (monograph)
- KREUER, Klaus-Dieter (Editor)1 ; MAIER, Joachim (Editor)1
[1] Max-Planck-Inst. Festkörperforschung, Stuttgart, Germany - Source
Solid state ionics. 1995, Vol 77, pp 3-9 ; ref : 19 ref
- CODEN
- SSIOD3
- ISSN
- 0167-2738
- Scientific domain
- Crystallography; Condensed state physics; Polymers, paint and wood industries
- Publisher
- Elsevier Science, Amsterdam
- Publication country
- Netherlands
- Document type
- Conference Paper
- Language
- English
- Keyword (fr)
- Calcul dynamique moléculaire Etude théorique Fonction distribution radiale Liaison hydrogène Migration Radical hydronium Saut Solution aqueuse Transfert proton
- Keyword (en)
- Molecular dynamics calculations Theoretical study Radial distribution function Hydrogen bonds Migration Hydronium radicals Hopping Aqueous solutions Proton transfer
- Keyword (es)
- Función distribución radial Transferencia protón
- Classification
- Pascal
- 001 Exact sciences and technology / 001B Physics / 001B60 Condensed matter: structure, mechanical and thermal properties / 001B60F Transport properties of condensed matter (nonelectronic) / 001B60F10 Diffusion and ionic conduction in liquids / 001B60F10E Ionic conduction
- Discipline
- Physics of condensed state : structure, mechanical and thermal properties
- Origin
- Inist-CNRS
- Database
- PASCAL
- INIST identifier
- 3540177
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
10.1016/0167-2738(94)00227-J 
https://dx.doi.org/10.1016/0167-2738(94)00227-J
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