Matches in SemOpenAlex for { <https://semopenalex.org/work/W2034196311> ?p ?o ?g. }
Showing items 1 to 98 of
98
with 100 items per page.
- W2034196311 endingPage "195" @default.
- W2034196311 startingPage "191" @default.
- W2034196311 abstract "Spin-orbit configuration-interaction calculations have been carried out on actinide complexes using relativistic core potentials and contracted Gaussian atomic orbitals. At present, this type of calculation gives moderate-accuracy results on ground states and excited states and on a number of molecular properties. Our previous work on uranocene has been continued with protactinocene, neptunocene, and plutonocene, giving the patterns of low-lying f→f states and higher-lying f→d and π→d states. Accurate magnetic moment values are obtained from these wavefunctions. The [email protected]60 and [email protected]28 complexes show extensive mixing of π orbitals with both 6d and 5f orbitals. The lower states of [email protected]28 are of π∗f and f2 character with the ground state appearing to be a π∗f state with mainly singlet character." @default.
- W2034196311 created "2016-06-24" @default.
- W2034196311 creator A5003311746 @default.
- W2034196311 creator A5016685265 @default.
- W2034196311 creator A5058863384 @default.
- W2034196311 creator A5075006366 @default.
- W2034196311 date "1994-10-01" @default.
- W2034196311 modified "2023-10-03" @default.
- W2034196311 title "Electronic structure of actinocenes and actinofullerenes" @default.
- W2034196311 cites W1667820781 @default.
- W2034196311 cites W1835505217 @default.
- W2034196311 cites W1980915044 @default.
- W2034196311 cites W1994379571 @default.
- W2034196311 cites W2001565573 @default.
- W2034196311 cites W2001710790 @default.
- W2034196311 cites W2053856533 @default.
- W2034196311 cites W2056262884 @default.
- W2034196311 cites W2056467753 @default.
- W2034196311 cites W2057349631 @default.
- W2034196311 cites W2058717303 @default.
- W2034196311 cites W2060644235 @default.
- W2034196311 cites W2067122065 @default.
- W2034196311 cites W2073578694 @default.
- W2034196311 cites W2082024019 @default.
- W2034196311 cites W2086005870 @default.
- W2034196311 cites W2093052439 @default.
- W2034196311 cites W4249204400 @default.
- W2034196311 doi "https://doi.org/10.1016/0925-8388(94)90902-4" @default.
- W2034196311 hasPublicationYear "1994" @default.
- W2034196311 type Work @default.
- W2034196311 sameAs 2034196311 @default.
- W2034196311 citedByCount "22" @default.
- W2034196311 countsByYear W20341963112014 @default.
- W2034196311 crossrefType "journal-article" @default.
- W2034196311 hasAuthorship W2034196311A5003311746 @default.
- W2034196311 hasAuthorship W2034196311A5016685265 @default.
- W2034196311 hasAuthorship W2034196311A5058863384 @default.
- W2034196311 hasAuthorship W2034196311A5075006366 @default.
- W2034196311 hasConcept C113603373 @default.
- W2034196311 hasConcept C121332964 @default.
- W2034196311 hasConcept C139358910 @default.
- W2034196311 hasConcept C147120987 @default.
- W2034196311 hasConcept C147597530 @default.
- W2034196311 hasConcept C181500209 @default.
- W2034196311 hasConcept C184779094 @default.
- W2034196311 hasConcept C185592680 @default.
- W2034196311 hasConcept C189394030 @default.
- W2034196311 hasConcept C2524010 @default.
- W2034196311 hasConcept C2777529809 @default.
- W2034196311 hasConcept C27799899 @default.
- W2034196311 hasConcept C2780861071 @default.
- W2034196311 hasConcept C32909587 @default.
- W2034196311 hasConcept C33062035 @default.
- W2034196311 hasConcept C33923547 @default.
- W2034196311 hasConcept C41455181 @default.
- W2034196311 hasConcept C62520636 @default.
- W2034196311 hasConcept C69523127 @default.
- W2034196311 hasConcept C86025842 @default.
- W2034196311 hasConceptScore W2034196311C113603373 @default.
- W2034196311 hasConceptScore W2034196311C121332964 @default.
- W2034196311 hasConceptScore W2034196311C139358910 @default.
- W2034196311 hasConceptScore W2034196311C147120987 @default.
- W2034196311 hasConceptScore W2034196311C147597530 @default.
- W2034196311 hasConceptScore W2034196311C181500209 @default.
- W2034196311 hasConceptScore W2034196311C184779094 @default.
- W2034196311 hasConceptScore W2034196311C185592680 @default.
- W2034196311 hasConceptScore W2034196311C189394030 @default.
- W2034196311 hasConceptScore W2034196311C2524010 @default.
- W2034196311 hasConceptScore W2034196311C2777529809 @default.
- W2034196311 hasConceptScore W2034196311C27799899 @default.
- W2034196311 hasConceptScore W2034196311C2780861071 @default.
- W2034196311 hasConceptScore W2034196311C32909587 @default.
- W2034196311 hasConceptScore W2034196311C33062035 @default.
- W2034196311 hasConceptScore W2034196311C33923547 @default.
- W2034196311 hasConceptScore W2034196311C41455181 @default.
- W2034196311 hasConceptScore W2034196311C62520636 @default.
- W2034196311 hasConceptScore W2034196311C69523127 @default.
- W2034196311 hasConceptScore W2034196311C86025842 @default.
- W2034196311 hasLocation W20341963111 @default.
- W2034196311 hasOpenAccess W2034196311 @default.
- W2034196311 hasPrimaryLocation W20341963111 @default.
- W2034196311 hasRelatedWork W1508026518 @default.
- W2034196311 hasRelatedWork W2008716661 @default.
- W2034196311 hasRelatedWork W2013066297 @default.
- W2034196311 hasRelatedWork W2020202890 @default.
- W2034196311 hasRelatedWork W2021466522 @default.
- W2034196311 hasRelatedWork W2026844487 @default.
- W2034196311 hasRelatedWork W2075024353 @default.
- W2034196311 hasRelatedWork W2083586904 @default.
- W2034196311 hasRelatedWork W2087161757 @default.
- W2034196311 hasRelatedWork W2091796415 @default.
- W2034196311 hasVolume "213-214" @default.
- W2034196311 isParatext "false" @default.
- W2034196311 isRetracted "false" @default.
- W2034196311 magId "2034196311" @default.
- W2034196311 workType "article" @default.