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rdf:type
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Description
| - Interaction energies of the model H-bonded complexes, the formamide and formamidine dimers, as well as the stacked formaldehyde and ethylene dimers are calculated by the coupled cluster CCSD(T) method. These systems serve as a model for H-bonded and stacking interactions, typical in molecules participating in biological systems.
- Interaction energies of the model H-bonded complexes, the formamide and formamidine dimers, as well as the stacked formaldehyde and ethylene dimers are calculated by the coupled cluster CCSD(T) method. These systems serve as a model for H-bonded and stacking interactions, typical in molecules participating in biological systems. (en)
- Interakční energie modelových komplexů s vodíkovými vazbami (dimer formamidu a dimer formamidinu) a patrovými interakcemi (farmaldehyd dimer a etylen dimer) byly vypočteny pomocí metody CCSD(T). tyto systémy slouží jako modely pro patrové interakce a vodíkové vazby, které jsou typické v biomakromolekulách. (cs)
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Title
| - Toward more efficient CCSD(T) calculations of intermolecular interactions in model Hydrogen-bonded and stacked dimers
- Toward more efficient CCSD(T) calculations of intermolecular interactions in model Hydrogen-bonded and stacked dimers (en)
- Efektivnější CCSD(T) výpočty interakčních energií modelových komplexů s vodíkovými vazbami a patrovými interakcemi (cs)
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skos:prefLabel
| - Toward more efficient CCSD(T) calculations of intermolecular interactions in model Hydrogen-bonded and stacked dimers
- Toward more efficient CCSD(T) calculations of intermolecular interactions in model Hydrogen-bonded and stacked dimers (en)
- Efektivnější CCSD(T) výpočty interakčních energií modelových komplexů s vodíkovými vazbami a patrovými interakcemi (cs)
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skos:notation
| - RIV/61388963:_____/08:00315801!RIV09-AV0-61388963
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http://linked.open...avai/riv/aktivita
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http://linked.open...avai/riv/aktivity
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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:_____/08:00315801
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http://linked.open...riv/jazykVysledku
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http://linked.open.../riv/klicovaSlova
| - CCSD(T); hydrogen bonding; stacking (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...UplatneniVysledku
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http://linked.open...v/svazekPeriodika
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http://linked.open...iv/tvurceVysledku
| - Urban, M.
- Černušák, I.
- Neogrady, P.
- Pitoňák, Michal
- Dědíková, P.
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http://linked.open...ain/vavai/riv/wos
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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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