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rdf:type
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Description
| - In the present study, the performance of six popular density functionals (B3LYP, PBE0, BLYP, BP86, PBE, and SVWN) for the description of the autoionization process in the water octamer was studied.
- In the present study, the performance of six popular density functionals (B3LYP, PBE0, BLYP, BP86, PBE, and SVWN) for the description of the autoionization process in the water octamer was studied. (en)
- V této studii byla zkoumána použitelnost šesti populárních funkcionálů hustoty (B3LYP, PBE0, BLYP, BP86, PBE, a SVWN) pro popis autoionizačního procesu v oktameru vody. (cs)
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Title
| - Cluster model for the ionic product of water: Accuracy and limitations of common density functional methods
- Cluster model for the ionic product of water: Accuracy and limitations of common density functional methods (en)
- Klastrový model iontového produktu vody: přesnost a omezení běžných funkcionálů hustoty (cs)
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skos:prefLabel
| - Cluster model for the ionic product of water: Accuracy and limitations of common density functional methods
- Cluster model for the ionic product of water: Accuracy and limitations of common density functional methods (en)
- Klastrový model iontového produktu vody: přesnost a omezení běžných funkcionálů hustoty (cs)
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skos:notation
| - RIV/61388963:_____/06:00041311!RIV07-AV0-61388963
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http://linked.open.../vavai/riv/strany
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http://linked.open...avai/riv/aktivita
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http://linked.open...avai/riv/aktivity
| - P(GA202/06/0286), P(LC512), Z(AV0Z4055905)
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http://linked.open...iv/cisloPeriodika
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http://linked.open...vai/riv/dodaniDat
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http://linked.open...aciTvurceVysledku
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http://linked.open.../riv/druhVysledku
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http://linked.open...iv/duvernostUdaju
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http://linked.open...titaPredkladatele
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http://linked.open...dnocenehoVysledku
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http://linked.open...ai/riv/idVysledku
| - RIV/61388963:_____/06:00041311
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http://linked.open...riv/jazykVysledku
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http://linked.open.../riv/klicovaSlova
| - autoionization of water; water octamer; density functional theory (en)
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http://linked.open.../riv/klicoveSlovo
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http://linked.open...odStatuVydavatele
| - US - Spojené státy americké
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http://linked.open...ontrolniKodProRIV
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http://linked.open...i/riv/nazevZdroje
| - Journal of Physical Chemistry. A
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http://linked.open...in/vavai/riv/obor
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http://linked.open...ichTvurcuVysledku
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http://linked.open...cetTvurcuVysledku
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http://linked.open...vavai/riv/projekt
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http://linked.open...UplatneniVysledku
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http://linked.open...v/svazekPeriodika
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http://linked.open...iv/tvurceVysledku
| - Jungwirth, Pavel
- Svozil, Daniel
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http://linked.open...n/vavai/riv/zamer
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issn
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number of pages
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is http://linked.open...avai/riv/vysledek
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