Matches in SemOpenAlex for { <https://semopenalex.org/work/W2085808596> ?p ?o ?g. }
Showing items 1 to 95 of
95
with 100 items per page.
- W2085808596 endingPage "552" @default.
- W2085808596 startingPage "543" @default.
- W2085808596 abstract "Ab initio SCF as well as pseudopotential calculations were performed for determining equilibrium structures and relative stabilities of several disilyne isomers. For the singlet state there are only two structures, the bridged and the silavinylidene carbene, which correspond to minima on the energy hypersurface. The most stable of the six isomeric structures investigated is the bridged conformer in the 1A1 electronic state, followed by the silavinylidene carbene in the 1A1 and 3A2 electronic states. Inclusion of electron correlation by MRD-CI calculations has no qualitative influence on the relative stabilities found in the SCF calculations." @default.
- W2085808596 created "2016-06-24" @default.
- W2085808596 creator A5007556540 @default.
- W2085808596 creator A5060656711 @default.
- W2085808596 creator A5087963045 @default.
- W2085808596 date "1984-03-01" @default.
- W2085808596 modified "2023-09-25" @default.
- W2085808596 title "Ab initio and pseudopotential calculations on the singlet and triplet states of the disilyne isomers" @default.
- W2085808596 cites W2017813412 @default.
- W2085808596 cites W2027815796 @default.
- W2085808596 cites W2074062296 @default.
- W2085808596 cites W2137608233 @default.
- W2085808596 cites W2950739677 @default.
- W2085808596 cites W2951082255 @default.
- W2085808596 cites W2972546054 @default.
- W2085808596 cites W3005461626 @default.
- W2085808596 cites W4230151690 @default.
- W2085808596 doi "https://doi.org/10.1002/qua.560250310" @default.
- W2085808596 hasPublicationYear "1984" @default.
- W2085808596 type Work @default.
- W2085808596 sameAs 2085808596 @default.
- W2085808596 citedByCount "51" @default.
- W2085808596 countsByYear W20858085962012 @default.
- W2085808596 countsByYear W20858085962013 @default.
- W2085808596 countsByYear W20858085962014 @default.
- W2085808596 countsByYear W20858085962015 @default.
- W2085808596 countsByYear W20858085962016 @default.
- W2085808596 countsByYear W20858085962017 @default.
- W2085808596 countsByYear W20858085962018 @default.
- W2085808596 countsByYear W20858085962019 @default.
- W2085808596 countsByYear W20858085962021 @default.
- W2085808596 countsByYear W20858085962023 @default.
- W2085808596 crossrefType "journal-article" @default.
- W2085808596 hasAuthorship W2085808596A5007556540 @default.
- W2085808596 hasAuthorship W2085808596A5060656711 @default.
- W2085808596 hasAuthorship W2085808596A5087963045 @default.
- W2085808596 hasConcept C121332964 @default.
- W2085808596 hasConcept C132378524 @default.
- W2085808596 hasConcept C147597530 @default.
- W2085808596 hasConcept C161790260 @default.
- W2085808596 hasConcept C178790620 @default.
- W2085808596 hasConcept C181500209 @default.
- W2085808596 hasConcept C183971685 @default.
- W2085808596 hasConcept C184779094 @default.
- W2085808596 hasConcept C185592680 @default.
- W2085808596 hasConcept C18705241 @default.
- W2085808596 hasConcept C2777164566 @default.
- W2085808596 hasConcept C2778529930 @default.
- W2085808596 hasConcept C2781442258 @default.
- W2085808596 hasConcept C32909587 @default.
- W2085808596 hasConcept C33062035 @default.
- W2085808596 hasConcept C35052450 @default.
- W2085808596 hasConcept C41999313 @default.
- W2085808596 hasConcept C76766466 @default.
- W2085808596 hasConcept C86025842 @default.
- W2085808596 hasConceptScore W2085808596C121332964 @default.
- W2085808596 hasConceptScore W2085808596C132378524 @default.
- W2085808596 hasConceptScore W2085808596C147597530 @default.
- W2085808596 hasConceptScore W2085808596C161790260 @default.
- W2085808596 hasConceptScore W2085808596C178790620 @default.
- W2085808596 hasConceptScore W2085808596C181500209 @default.
- W2085808596 hasConceptScore W2085808596C183971685 @default.
- W2085808596 hasConceptScore W2085808596C184779094 @default.
- W2085808596 hasConceptScore W2085808596C185592680 @default.
- W2085808596 hasConceptScore W2085808596C18705241 @default.
- W2085808596 hasConceptScore W2085808596C2777164566 @default.
- W2085808596 hasConceptScore W2085808596C2778529930 @default.
- W2085808596 hasConceptScore W2085808596C2781442258 @default.
- W2085808596 hasConceptScore W2085808596C32909587 @default.
- W2085808596 hasConceptScore W2085808596C33062035 @default.
- W2085808596 hasConceptScore W2085808596C35052450 @default.
- W2085808596 hasConceptScore W2085808596C41999313 @default.
- W2085808596 hasConceptScore W2085808596C76766466 @default.
- W2085808596 hasConceptScore W2085808596C86025842 @default.
- W2085808596 hasIssue "3" @default.
- W2085808596 hasLocation W20858085961 @default.
- W2085808596 hasOpenAccess W2085808596 @default.
- W2085808596 hasPrimaryLocation W20858085961 @default.
- W2085808596 hasRelatedWork W1965606104 @default.
- W2085808596 hasRelatedWork W1974806592 @default.
- W2085808596 hasRelatedWork W1979578315 @default.
- W2085808596 hasRelatedWork W2003797532 @default.
- W2085808596 hasRelatedWork W2005115686 @default.
- W2085808596 hasRelatedWork W2006119058 @default.
- W2085808596 hasRelatedWork W2074667523 @default.
- W2085808596 hasRelatedWork W2085808596 @default.
- W2085808596 hasRelatedWork W2147451454 @default.
- W2085808596 hasRelatedWork W2181072655 @default.
- W2085808596 hasVolume "25" @default.
- W2085808596 isParatext "false" @default.
- W2085808596 isRetracted "false" @default.
- W2085808596 magId "2085808596" @default.
- W2085808596 workType "article" @default.