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Molecular level properties of the free water surface and different organic liquid/water interfaces, as seen from ITIM analysis of computer simulation results

Author
HANTAL, György1 2 ; DARVAS, Mária1 2 ; PARTAY, Livia B3 ; HORVAI, George4 5 ; JEDLOVSZKY, Pál1 4 6
[1] Laboratory of Interfaces and Nanosize Systems, Institute of Chemistry, Eötvös Loránd University, Pázmány P Stny 1/A, 1117 Budapest, Hungary
[2] Institut UTINAM (CNRS UMR 6213), Université de Franche-Comté, 16 route de Gray, 25030 Besançon, France
[3] University Chemical Laboratory, University of Cambridge, Lensfield Road, Cambridge CB2 1EW, United Kingdom
[4] HAS Research Group of Technical Analytical Chemistry, Szt Gellért tér 4, 1111 Budapest, Hungary
[5] Department of Inorganic and Analytical Chemistry, Budapest University of Technology and Economics, Szt Gellért tér 4, 1111 Budapest, Hungary
[6] EKF Department of Chemistry, Leányka u. 6, 3300 Eger, Hungary
Conference name
Modeling and Simulation of Water at Interfaces from Ambient to Supercooled Conditions. Workshop (2009)
Source

Journal of physics. Condensed matter (Print). 2010, Vol 22, Num 28 ; 284112.1-284112.14 ; ref : 72 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
Conference Paper
Language
English
Keyword (fr)
Eau Effet échelle Ensemble canonique Interface fluide fluide Méthode dynamique moléculaire Orientation moléculaire Propriété interface Rugosité Simulation ordinateur Subsurface
Keyword (en)
Water Scale effect Canonical ensemble Fluid-fluid interfaces Molecular dynamics method Molecular orientation Interface properties Roughness Computerized simulation Subsurface
Keyword (es)
Efecto escala Propiedad interfase Subsuelo
Classification
Pascal
001 Exact sciences and technology / 001B Physics / 001B60 Condensed matter: structure, mechanical and thermal properties / 001B60H Surfaces and interfaces; thin films and whiskers (structure and nonelectronic properties) / 001B60H10 Fluid surfaces and fluid-fluid interfaces

Discipline
Physics of condensed state : structure, mechanical and thermal properties
Origin
Inist-CNRS
Database
PASCAL
INIST identifier
23025871

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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