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Description
| - The nature of the Ga-Ga bond in the naked dianion PhGaGaPh2- and its Na+-coordinated counterpart is discussed using the recently proposed formalism based on the analysis of domain-averaged Fermi holes. The analysis shows clearly that three electron pairs, i.e., two sigma and one pi, contribute to the Ga-Ga bonding interactions in the free dianion PhGaGaPh2- and in the sodium-complexed species (PhGaGaPh)Na-2. The eigenvalues and the eigenvectors of the Fermi hole indicate, however, that the Ga-Ga bonding situation does not correspond to classical triple bonds and should not be interpreted using classical bonding models
- The nature of the Ga-Ga bond in the naked dianion PhGaGaPh2- and its Na+-coordinated counterpart is discussed using the recently proposed formalism based on the analysis of domain-averaged Fermi holes. The analysis shows clearly that three electron pairs, i.e., two sigma and one pi, contribute to the Ga-Ga bonding interactions in the free dianion PhGaGaPh2- and in the sodium-complexed species (PhGaGaPh)Na-2. The eigenvalues and the eigenvectors of the Fermi hole indicate, however, that the Ga-Ga bonding situation does not correspond to classical triple bonds and should not be interpreted using classical bonding models (en)
- Povaha vazby GaGa v dianiontu PhGaGaPh(2-) a jeho dvojnásobně Na+ koordinované soli je diskutována pomocí nedávno navrženého formalismu založeného na analyse doménově průměrovaných Fermiho děr. Analysa ukázala, že k vazbě v obou sloučeninách přispívají 3 elektronové páry tvořící jednu pi a dvě sigma komponenty. Vlastní hodnoty a vlastní vektory příslušných Fermiho děr ukazují, že vazba neodpovídá klasické trojné vazbě a že nemůže být interpretována pomocí klasického modelu chemické vazby (cs)
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Title
| - Chemical Structures from the Analysis of Domain Averaged Fermi holes. The Nature of GaGa Bonding in PhGaGaPh(2-) and PhGaGaPhNa2
- Chemická struktura z analysy doménově průměrovaných Fermiho děr. Povaha vazby GaGa v PhGaGaPh(2-) a PhGaGaPhNa2 (cs)
- Chemical Structures from the Analysis of Domain Averaged Fermi holes. The Nature of GaGa Bonding in PhGaGaPh(2-) and PhGaGaPhNa2 (en)
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skos:prefLabel
| - Chemical Structures from the Analysis of Domain Averaged Fermi holes. The Nature of GaGa Bonding in PhGaGaPh(2-) and PhGaGaPhNa2
- Chemická struktura z analysy doménově průměrovaných Fermiho děr. Povaha vazby GaGa v PhGaGaPh(2-) a PhGaGaPhNa2 (cs)
- Chemical Structures from the Analysis of Domain Averaged Fermi holes. The Nature of GaGa Bonding in PhGaGaPh(2-) and PhGaGaPhNa2 (en)
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skos:notation
| - RIV/67985858:_____/04:00104855!RIV/2005/AV0/A27005/N
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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(IAA4072006), Z(AV0Z4072921)
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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/67985858:_____/04:00104855
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http://linked.open...riv/jazykVysledku
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http://linked.open.../riv/klicovaSlova
| - Ga-Ga bonding;domain averaged fermi holes (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
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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
| - Ponec, Robert
- Gironés, X.
- Frenking, G.
- Juzhakov, Gleb
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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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