Matches in SemOpenAlex for { <https://semopenalex.org/work/W2088802165> ?p ?o ?g. }
Showing items 1 to 91 of
91
with 100 items per page.
- W2088802165 endingPage "3525" @default.
- W2088802165 startingPage "3521" @default.
- W2088802165 abstract "A LCAO–MO parametric calculation of chromate ion in terms of a single quantity β, the ligand mixing coefficient, has been carried out. The values of both dipole length (QtheoretL) and dipole velocity (QtheoretV) transition moments for A11 → 1T2 (t1 → 2e) transition of the chromate ion have been computed as functions of ligand mixing coefficient on the bases of Slater-type of orbitals (STO's) and more exact AO's formed by combination of 2p STO's with double-ζ3d AO's which duplicate as nearly as possible the SCF AO's. The contribution of charge transfer integral (Q1) and one-center (Q2) and two-center (Q3) ligand integrals to the transition moments as functions of β have also been estimated. Whereas QtheoretV is sensitive, QtheoretL is insensitive to change in the 3d radial function. The dipole transition moments are in better agreement with the experimental value when the Richardson's orbitals are used instead of STO's. The use of dipole velocity operator leads to better results than that of dipole length operator. As a by-product based on simplifying assumptions, the chromate ion appears to possess less π bonding than the permanganate ion." @default.
- W2088802165 created "2016-06-24" @default.
- W2088802165 creator A5079220415 @default.
- W2088802165 date "1970-04-01" @default.
- W2088802165 modified "2023-09-25" @default.
- W2088802165 title "Dipole Transition Moments of Chromate Ion" @default.
- W2088802165 cites W1604672137 @default.
- W2088802165 cites W1970444753 @default.
- W2088802165 cites W1986647117 @default.
- W2088802165 cites W2000627212 @default.
- W2088802165 cites W2025661178 @default.
- W2088802165 cites W2043795087 @default.
- W2088802165 cites W2049677585 @default.
- W2088802165 cites W2053930881 @default.
- W2088802165 cites W2060501150 @default.
- W2088802165 cites W2123778996 @default.
- W2088802165 cites W2146256869 @default.
- W2088802165 cites W2329702161 @default.
- W2088802165 cites W4230866049 @default.
- W2088802165 doi "https://doi.org/10.1063/1.1673516" @default.
- W2088802165 hasPublicationYear "1970" @default.
- W2088802165 type Work @default.
- W2088802165 sameAs 2088802165 @default.
- W2088802165 citedByCount "4" @default.
- W2088802165 crossrefType "journal-article" @default.
- W2088802165 hasAuthorship W2088802165A5079220415 @default.
- W2088802165 hasConcept C104317684 @default.
- W2088802165 hasConcept C121332964 @default.
- W2088802165 hasConcept C138775182 @default.
- W2088802165 hasConcept C145148216 @default.
- W2088802165 hasConcept C147120987 @default.
- W2088802165 hasConcept C147597530 @default.
- W2088802165 hasConcept C152365726 @default.
- W2088802165 hasConcept C158448853 @default.
- W2088802165 hasConcept C17020691 @default.
- W2088802165 hasConcept C173523689 @default.
- W2088802165 hasConcept C178790620 @default.
- W2088802165 hasConcept C184779094 @default.
- W2088802165 hasConcept C185592680 @default.
- W2088802165 hasConcept C189394030 @default.
- W2088802165 hasConcept C205688572 @default.
- W2088802165 hasConcept C41999313 @default.
- W2088802165 hasConcept C511782168 @default.
- W2088802165 hasConcept C53848692 @default.
- W2088802165 hasConcept C55493867 @default.
- W2088802165 hasConcept C62520636 @default.
- W2088802165 hasConcept C65956243 @default.
- W2088802165 hasConcept C86339819 @default.
- W2088802165 hasConceptScore W2088802165C104317684 @default.
- W2088802165 hasConceptScore W2088802165C121332964 @default.
- W2088802165 hasConceptScore W2088802165C138775182 @default.
- W2088802165 hasConceptScore W2088802165C145148216 @default.
- W2088802165 hasConceptScore W2088802165C147120987 @default.
- W2088802165 hasConceptScore W2088802165C147597530 @default.
- W2088802165 hasConceptScore W2088802165C152365726 @default.
- W2088802165 hasConceptScore W2088802165C158448853 @default.
- W2088802165 hasConceptScore W2088802165C17020691 @default.
- W2088802165 hasConceptScore W2088802165C173523689 @default.
- W2088802165 hasConceptScore W2088802165C178790620 @default.
- W2088802165 hasConceptScore W2088802165C184779094 @default.
- W2088802165 hasConceptScore W2088802165C185592680 @default.
- W2088802165 hasConceptScore W2088802165C189394030 @default.
- W2088802165 hasConceptScore W2088802165C205688572 @default.
- W2088802165 hasConceptScore W2088802165C41999313 @default.
- W2088802165 hasConceptScore W2088802165C511782168 @default.
- W2088802165 hasConceptScore W2088802165C53848692 @default.
- W2088802165 hasConceptScore W2088802165C55493867 @default.
- W2088802165 hasConceptScore W2088802165C62520636 @default.
- W2088802165 hasConceptScore W2088802165C65956243 @default.
- W2088802165 hasConceptScore W2088802165C86339819 @default.
- W2088802165 hasIssue "7" @default.
- W2088802165 hasLocation W20888021651 @default.
- W2088802165 hasOpenAccess W2088802165 @default.
- W2088802165 hasPrimaryLocation W20888021651 @default.
- W2088802165 hasRelatedWork W1973878640 @default.
- W2088802165 hasRelatedWork W1991621710 @default.
- W2088802165 hasRelatedWork W2006178299 @default.
- W2088802165 hasRelatedWork W2014826411 @default.
- W2088802165 hasRelatedWork W2024768508 @default.
- W2088802165 hasRelatedWork W2037084421 @default.
- W2088802165 hasRelatedWork W2053624788 @default.
- W2088802165 hasRelatedWork W2088802165 @default.
- W2088802165 hasRelatedWork W2097494835 @default.
- W2088802165 hasRelatedWork W2107541279 @default.
- W2088802165 hasVolume "52" @default.
- W2088802165 isParatext "false" @default.
- W2088802165 isRetracted "false" @default.
- W2088802165 magId "2088802165" @default.
- W2088802165 workType "article" @default.