Matches in SemOpenAlex for { <https://semopenalex.org/work/W1663784338> ?p ?o ?g. }
Showing items 1 to 82 of
82
with 100 items per page.
- W1663784338 endingPage "62" @default.
- W1663784338 startingPage "49" @default.
- W1663784338 abstract "The separated pair method, for systems containing even and odd numbers of electrons, is generalized by allowing for contributions from all available spin coupled states of the same total spin quantum numbers S and M. The total wavefunction is expressed as a linear combination of products of a given spin eigenfunction, which is constructed out of singlet and triplet coupled pairs, and a suitable spatial function built out of symmetric (for singlet) and antisymmetric (for triplet) spatial pair functions. The electron and spin density functions are then presented in a ‘ sum of pair ’ densities form, so enabling the effects of spin optimization on the chemical bonding to be interpreted in a simple and obvious way. Finally, a discussion is given of the practical application of the spin optimized separated pair method." @default.
- W1663784338 created "2016-06-24" @default.
- W1663784338 creator A5061009689 @default.
- W1663784338 creator A5068238376 @default.
- W1663784338 date "1975-07-01" @default.
- W1663784338 modified "2023-10-16" @default.
- W1663784338 title "The spin optimized separated pair method" @default.
- W1663784338 cites W1575110448 @default.
- W1663784338 cites W1983981378 @default.
- W1663784338 cites W1992106919 @default.
- W1663784338 cites W1998342034 @default.
- W1663784338 cites W1998705691 @default.
- W1663784338 cites W1999528125 @default.
- W1663784338 cites W2003376663 @default.
- W1663784338 cites W2003613778 @default.
- W1663784338 cites W2008345487 @default.
- W1663784338 cites W2012932237 @default.
- W1663784338 cites W2017143276 @default.
- W1663784338 cites W2019605072 @default.
- W1663784338 cites W2023497750 @default.
- W1663784338 cites W2031731980 @default.
- W1663784338 cites W2050764527 @default.
- W1663784338 cites W2051410685 @default.
- W1663784338 cites W2054388307 @default.
- W1663784338 cites W2061961192 @default.
- W1663784338 cites W2066194464 @default.
- W1663784338 cites W2068607512 @default.
- W1663784338 cites W2070141598 @default.
- W1663784338 cites W2070202320 @default.
- W1663784338 cites W2091987798 @default.
- W1663784338 cites W2132347175 @default.
- W1663784338 cites W2163191325 @default.
- W1663784338 cites W2203939799 @default.
- W1663784338 cites W2327275701 @default.
- W1663784338 cites W2332429490 @default.
- W1663784338 cites W56322847 @default.
- W1663784338 doi "https://doi.org/10.1080/00268977500101751" @default.
- W1663784338 hasPublicationYear "1975" @default.
- W1663784338 type Work @default.
- W1663784338 sameAs 1663784338 @default.
- W1663784338 citedByCount "10" @default.
- W1663784338 countsByYear W16637843382013 @default.
- W1663784338 crossrefType "journal-article" @default.
- W1663784338 hasAuthorship W1663784338A5061009689 @default.
- W1663784338 hasAuthorship W1663784338A5068238376 @default.
- W1663784338 hasConcept C121332964 @default.
- W1663784338 hasConcept C184779094 @default.
- W1663784338 hasConcept C185592680 @default.
- W1663784338 hasConcept C192562407 @default.
- W1663784338 hasConcept C33332235 @default.
- W1663784338 hasConcept C41999313 @default.
- W1663784338 hasConcept C42704618 @default.
- W1663784338 hasConcept C97355855 @default.
- W1663784338 hasConceptScore W1663784338C121332964 @default.
- W1663784338 hasConceptScore W1663784338C184779094 @default.
- W1663784338 hasConceptScore W1663784338C185592680 @default.
- W1663784338 hasConceptScore W1663784338C192562407 @default.
- W1663784338 hasConceptScore W1663784338C33332235 @default.
- W1663784338 hasConceptScore W1663784338C41999313 @default.
- W1663784338 hasConceptScore W1663784338C42704618 @default.
- W1663784338 hasConceptScore W1663784338C97355855 @default.
- W1663784338 hasIssue "1" @default.
- W1663784338 hasLocation W16637843381 @default.
- W1663784338 hasOpenAccess W1663784338 @default.
- W1663784338 hasPrimaryLocation W16637843381 @default.
- W1663784338 hasRelatedWork W1988714347 @default.
- W1663784338 hasRelatedWork W1989198750 @default.
- W1663784338 hasRelatedWork W1992276290 @default.
- W1663784338 hasRelatedWork W1997086491 @default.
- W1663784338 hasRelatedWork W2000399967 @default.
- W1663784338 hasRelatedWork W2091942342 @default.
- W1663784338 hasRelatedWork W2095055141 @default.
- W1663784338 hasRelatedWork W2899084033 @default.
- W1663784338 hasRelatedWork W3098248856 @default.
- W1663784338 hasRelatedWork W4255514593 @default.
- W1663784338 hasVolume "30" @default.
- W1663784338 isParatext "false" @default.
- W1663784338 isRetracted "false" @default.
- W1663784338 magId "1663784338" @default.
- W1663784338 workType "article" @default.