Matches in SemOpenAlex for { <https://semopenalex.org/work/W2024459564> ?p ?o ?g. }
- W2024459564 endingPage "10008" @default.
- W2024459564 startingPage "10001" @default.
- W2024459564 abstract "The population analysis along the intrinsic reaction coordinate (IRC) has been performed, taking 1,3-dipolar cycloaddition as an example. By calculating the derivatives of the Mulliken atomic charge and the Giambiagi bond order with respect to nuclear motions analytically, a decomposition of the derivatives into two components, the density derivative term and the overlap derivative term, has been demonstrated. The density derivative term represents the effect of redistribution of electrons due to the nuclear motion. By using this method, the electronic character of asynchronous bond formation in 1,3-dipolar addition between fluminic acid and acetylene has been revealed clearly." @default.
- W2024459564 created "2016-06-24" @default.
- W2024459564 creator A5017998169 @default.
- W2024459564 date "2000-10-19" @default.
- W2024459564 modified "2023-10-03" @default.
- W2024459564 title "Electron Reorganization along the Intrinsic Reaction Coordinate in 1,3-Dipolar Cycloaddition" @default.
- W2024459564 cites W1650728208 @default.
- W2024459564 cites W1964337872 @default.
- W2024459564 cites W1968532525 @default.
- W2024459564 cites W1969116739 @default.
- W2024459564 cites W1971292001 @default.
- W2024459564 cites W1977762520 @default.
- W2024459564 cites W1980753286 @default.
- W2024459564 cites W1984666211 @default.
- W2024459564 cites W1986244945 @default.
- W2024459564 cites W1987668957 @default.
- W2024459564 cites W1987720018 @default.
- W2024459564 cites W1989020966 @default.
- W2024459564 cites W1992173555 @default.
- W2024459564 cites W1996204577 @default.
- W2024459564 cites W1997184962 @default.
- W2024459564 cites W2000872531 @default.
- W2024459564 cites W2010632296 @default.
- W2024459564 cites W2011079470 @default.
- W2024459564 cites W2014767176 @default.
- W2024459564 cites W2016353244 @default.
- W2024459564 cites W2017369943 @default.
- W2024459564 cites W2022950330 @default.
- W2024459564 cites W2023448479 @default.
- W2024459564 cites W2026717788 @default.
- W2024459564 cites W2030477091 @default.
- W2024459564 cites W2031776781 @default.
- W2024459564 cites W2031918209 @default.
- W2024459564 cites W2032381493 @default.
- W2024459564 cites W2032755939 @default.
- W2024459564 cites W2033990154 @default.
- W2024459564 cites W2038767330 @default.
- W2024459564 cites W2042495131 @default.
- W2024459564 cites W2042944554 @default.
- W2024459564 cites W2048611687 @default.
- W2024459564 cites W2051424058 @default.
- W2024459564 cites W2058105906 @default.
- W2024459564 cites W2058319754 @default.
- W2024459564 cites W2069920740 @default.
- W2024459564 cites W2070524007 @default.
- W2024459564 cites W2073541272 @default.
- W2024459564 cites W2075673850 @default.
- W2024459564 cites W2078946683 @default.
- W2024459564 cites W2080558492 @default.
- W2024459564 cites W2082309611 @default.
- W2024459564 cites W2082497477 @default.
- W2024459564 cites W2082806933 @default.
- W2024459564 cites W2084703575 @default.
- W2024459564 cites W2085196971 @default.
- W2024459564 cites W2085354509 @default.
- W2024459564 cites W2127996288 @default.
- W2024459564 cites W2159570720 @default.
- W2024459564 cites W2624539262 @default.
- W2024459564 cites W2952198191 @default.
- W2024459564 cites W3009331727 @default.
- W2024459564 doi "https://doi.org/10.1021/jp0020539" @default.
- W2024459564 hasPublicationYear "2000" @default.
- W2024459564 type Work @default.
- W2024459564 sameAs 2024459564 @default.
- W2024459564 citedByCount "17" @default.
- W2024459564 countsByYear W20244595642013 @default.
- W2024459564 countsByYear W20244595642017 @default.
- W2024459564 crossrefType "journal-article" @default.
- W2024459564 hasAuthorship W2024459564A5017998169 @default.
- W2024459564 hasConcept C106159729 @default.
- W2024459564 hasConcept C111771559 @default.
- W2024459564 hasConcept C121332964 @default.
- W2024459564 hasConcept C125485243 @default.
- W2024459564 hasConcept C144024400 @default.
- W2024459564 hasConcept C147120987 @default.
- W2024459564 hasConcept C147597530 @default.
- W2024459564 hasConcept C149923435 @default.
- W2024459564 hasConcept C150708132 @default.
- W2024459564 hasConcept C152365726 @default.
- W2024459564 hasConcept C161790260 @default.
- W2024459564 hasConcept C162324750 @default.
- W2024459564 hasConcept C173523689 @default.
- W2024459564 hasConcept C17744445 @default.
- W2024459564 hasConcept C178790620 @default.
- W2024459564 hasConcept C18553476 @default.
- W2024459564 hasConcept C185592680 @default.
- W2024459564 hasConcept C198179714 @default.
- W2024459564 hasConcept C199539241 @default.
- W2024459564 hasConcept C2777419590 @default.
- W2024459564 hasConcept C2777517455 @default.
- W2024459564 hasConcept C2779664164 @default.
- W2024459564 hasConcept C2908647359 @default.
- W2024459564 hasConcept C41999313 @default.
- W2024459564 hasConcept C62520636 @default.
- W2024459564 hasConcept C7214806 @default.
- W2024459564 hasConcept C74080474 @default.
- W2024459564 hasConcept C75473681 @default.
- W2024459564 hasConcept C94625758 @default.