Matches in SemOpenAlex for { <https://semopenalex.org/work/W2950698520> ?p ?o ?g. }
Showing items 1 to 83 of
83
with 100 items per page.
- W2950698520 abstract "Theoretical methods based on density functional theory using hybrid functionals provide good estimates of the exchange coupling constants for complexes with metals of the second transition series, with accuracy similar to that previously obtained for complexes with lighter transition metals. The influence of the basis set and effective core potentials has been analyzed. The more diffuse nature of the 4d orbitals, in comparison with the 3d ones, considerably modifies the electronic structure and, consequently, the magnetic properties enhancing the antiferromagnetic contributions. (© Wiley-VCH Verlag GmbH & Co. KGaA, 69451 Weinheim, Germany, 2003)" @default.
- W2950698520 created "2019-06-27" @default.
- W2950698520 creator A5024602124 @default.
- W2950698520 creator A5036776386 @default.
- W2950698520 creator A5039320439 @default.
- W2950698520 date "2003-07-22" @default.
- W2950698520 modified "2023-09-27" @default.
- W2950698520 title "Exchange Coupling in Metal Complexes of the Second Transition Series: A Theoretical Exploration" @default.
- W2950698520 cites W2096817500 @default.
- W2950698520 doi "https://doi.org/10.1002/chin.200329001" @default.
- W2950698520 hasPublicationYear "2003" @default.
- W2950698520 type Work @default.
- W2950698520 sameAs 2950698520 @default.
- W2950698520 citedByCount "0" @default.
- W2950698520 crossrefType "journal-article" @default.
- W2950698520 hasAuthorship W2950698520A5024602124 @default.
- W2950698520 hasAuthorship W2950698520A5036776386 @default.
- W2950698520 hasAuthorship W2950698520A5039320439 @default.
- W2950698520 hasConcept C106773901 @default.
- W2950698520 hasConcept C121332964 @default.
- W2950698520 hasConcept C131584629 @default.
- W2950698520 hasConcept C143724316 @default.
- W2950698520 hasConcept C147120987 @default.
- W2950698520 hasConcept C147597530 @default.
- W2950698520 hasConcept C151730666 @default.
- W2950698520 hasConcept C152365726 @default.
- W2950698520 hasConcept C155355069 @default.
- W2950698520 hasConcept C159467904 @default.
- W2950698520 hasConcept C159985019 @default.
- W2950698520 hasConcept C161790260 @default.
- W2950698520 hasConcept C178790620 @default.
- W2950698520 hasConcept C183276030 @default.
- W2950698520 hasConcept C185592680 @default.
- W2950698520 hasConcept C189394030 @default.
- W2950698520 hasConcept C191897082 @default.
- W2950698520 hasConcept C192562407 @default.
- W2950698520 hasConcept C2164484 @default.
- W2950698520 hasConcept C22693506 @default.
- W2950698520 hasConcept C26873012 @default.
- W2950698520 hasConcept C62520636 @default.
- W2950698520 hasConcept C65956243 @default.
- W2950698520 hasConcept C86803240 @default.
- W2950698520 hasConceptScore W2950698520C106773901 @default.
- W2950698520 hasConceptScore W2950698520C121332964 @default.
- W2950698520 hasConceptScore W2950698520C131584629 @default.
- W2950698520 hasConceptScore W2950698520C143724316 @default.
- W2950698520 hasConceptScore W2950698520C147120987 @default.
- W2950698520 hasConceptScore W2950698520C147597530 @default.
- W2950698520 hasConceptScore W2950698520C151730666 @default.
- W2950698520 hasConceptScore W2950698520C152365726 @default.
- W2950698520 hasConceptScore W2950698520C155355069 @default.
- W2950698520 hasConceptScore W2950698520C159467904 @default.
- W2950698520 hasConceptScore W2950698520C159985019 @default.
- W2950698520 hasConceptScore W2950698520C161790260 @default.
- W2950698520 hasConceptScore W2950698520C178790620 @default.
- W2950698520 hasConceptScore W2950698520C183276030 @default.
- W2950698520 hasConceptScore W2950698520C185592680 @default.
- W2950698520 hasConceptScore W2950698520C189394030 @default.
- W2950698520 hasConceptScore W2950698520C191897082 @default.
- W2950698520 hasConceptScore W2950698520C192562407 @default.
- W2950698520 hasConceptScore W2950698520C2164484 @default.
- W2950698520 hasConceptScore W2950698520C22693506 @default.
- W2950698520 hasConceptScore W2950698520C26873012 @default.
- W2950698520 hasConceptScore W2950698520C62520636 @default.
- W2950698520 hasConceptScore W2950698520C65956243 @default.
- W2950698520 hasConceptScore W2950698520C86803240 @default.
- W2950698520 hasLocation W29506985201 @default.
- W2950698520 hasOpenAccess W2950698520 @default.
- W2950698520 hasPrimaryLocation W29506985201 @default.
- W2950698520 hasRelatedWork W1964524228 @default.
- W2950698520 hasRelatedWork W1983644133 @default.
- W2950698520 hasRelatedWork W2016101031 @default.
- W2950698520 hasRelatedWork W2065717359 @default.
- W2950698520 hasRelatedWork W2075650720 @default.
- W2950698520 hasRelatedWork W2316991895 @default.
- W2950698520 hasRelatedWork W2319339021 @default.
- W2950698520 hasRelatedWork W2340779471 @default.
- W2950698520 hasRelatedWork W2951958979 @default.
- W2950698520 hasRelatedWork W2952431349 @default.
- W2950698520 isParatext "false" @default.
- W2950698520 isRetracted "false" @default.
- W2950698520 magId "2950698520" @default.
- W2950698520 workType "article" @default.