About: The onset of ion solvation by ab initio calculations: Comparison of water and methanol

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An Entity of Type : http://linked.opendata.cz/ontology/domain/vavai/Vysledek, within Data Space : linked.opendata.cz associated with source document(s)

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rdf:type	skos:Concept http://linked.opendata.cz/ontology/domain/vavai/Vysledek
Description	Optimal structures as well as vertical and adiabatic desolvation energies for sodium cation and fluoride and chloride anions in clusters with one to three water or methanol molecules are determined using converging ab initio methods. Optimal structures as well as vertical and adiabatic desolvation energies for sodium cation and fluoride and chloride anions in clusters with one to three water or methanol molecules are determined using converging ab initio methods. (en) Optimální struktury a vertikální a adiabatické desolvatační energie pro sodík, florid a chlorid s jednou až třemi molekulami vody nebo metanolu byly určeny pomocí konvergujících ab initio metod. (cs)
Title	The onset of ion solvation by ab initio calculations: Comparison of water and methanol The onset of ion solvation by ab initio calculations: Comparison of water and methanol (en) Počátky iontové solvatace pomocí ab initio výpočtů: srovnání vody a metanolu (cs)
skos:prefLabel	The onset of ion solvation by ab initio calculations: Comparison of water and methanol The onset of ion solvation by ab initio calculations: Comparison of water and methanol (en) Počátky iontové solvatace pomocí ab initio výpočtů: srovnání vody a metanolu (cs)
skos:notation	RIV/61388963:_____/08:00312709!RIV09-AV0-61388963
http://linked.open...avai/riv/aktivita	P Z
http://linked.open...avai/riv/aktivity	P(GA203/07/1006), P(LC512), Z(AV0Z40550506)
http://linked.open...iv/cisloPeriodika	6/7
http://linked.open...vai/riv/dodaniDat	2009
http://linked.open...aciTvurceVysledku	Pluhařová, Eva Jungwirth, Pavel
http://linked.open.../riv/druhVysledku	J - Článek v odborném periodiku
http://linked.open...iv/duvernostUdaju	S - Úplné a pravdivé údaje nepodléhající ochraně podle zvláštních právních předpisů
http://linked.open...titaPredkladatele	Ústav organické chemie a biochemie AV ČR, v. v. i.
http://linked.open...dnocenehoVysledku	384877
http://linked.open...ai/riv/idVysledku	RIV/61388963:_____/08:00312709
http://linked.open...riv/jazykVysledku	eng - angličtina
http://linked.open.../riv/klicovaSlova	ions; water cluster; methanol; ab initio calculations (en)
http://linked.open.../riv/klicoveSlovo	ions water cluster ab initio calculations methanol
http://linked.open...odStatuVydavatele	CZ - Česká republika
http://linked.open...ontrolniKodProRIV	[5C9CD004469A]
http://linked.open...i/riv/nazevZdroje	Collection of Czechoslovak Chemical Communications
http://linked.open...in/vavai/riv/obor	CF
http://linked.open...ichTvurcuVysledku	2 (xsd:int)
http://linked.open...cetTvurcuVysledku	2 (xsd:int)
http://linked.open...vavai/riv/projekt	Center for biomolecules and complex molecular systems Combined experimental and theoretical investigation of the structure of ionic liquid surfaces and interfaces
http://linked.open...UplatneniVysledku	2008
http://linked.open...v/svazekPeriodika	73
http://linked.open...iv/tvurceVysledku	Jungwirth, Pavel Pluhařová, Eva
http://linked.open...ain/vavai/riv/wos	000260536700001
http://linked.open...n/vavai/riv/zamer	Regulace biologických procesů: Chemické modulátory vybraných systémů významných pro medicínu a zemědělství
issn	0010-0765
number of pages	12 (xsd:int)

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