Matches in SemOpenAlex for { <https://semopenalex.org/work/W2380015812> ?p ?o ?g. }
Showing items 1 to 61 of
61
with 100 items per page.
- W2380015812 abstract "The reaction mechanism of CH (X~2Π) radical with NH_3 was studied by means of quantum chemical methods. The geometries for all the stationary points on the potential energy surfaces were optimized fully at the B3LYP/6-311++G(d, p), B3LYP/6-311++G(3df, 3pd), MP2/6-311++G(d, p) and MP2/6-311++G(3df, 3pd) levels, respectively. All the transition states were confirmed by the IRC calculations at the B3LYP/6-311++G(3df, 3pd) level. The reaction mechanism were confirmed." @default.
- W2380015812 created "2016-06-24" @default.
- W2380015812 creator A5007394011 @default.
- W2380015812 date "2005-01-01" @default.
- W2380015812 modified "2023-09-23" @default.
- W2380015812 title "Quantum Chemical Study on the Reaction of CH (X~2Π) Radical with NH_3" @default.
- W2380015812 hasPublicationYear "2005" @default.
- W2380015812 type Work @default.
- W2380015812 sameAs 2380015812 @default.
- W2380015812 citedByCount "0" @default.
- W2380015812 crossrefType "journal-article" @default.
- W2380015812 hasAuthorship W2380015812A5007394011 @default.
- W2380015812 hasConcept C147597530 @default.
- W2380015812 hasConcept C147789679 @default.
- W2380015812 hasConcept C161790260 @default.
- W2380015812 hasConcept C178790620 @default.
- W2380015812 hasConcept C185592680 @default.
- W2380015812 hasConcept C22994065 @default.
- W2380015812 hasConcept C2991951333 @default.
- W2380015812 hasConcept C32909587 @default.
- W2380015812 hasConcept C65024703 @default.
- W2380015812 hasConcept C89031862 @default.
- W2380015812 hasConcept C95121573 @default.
- W2380015812 hasConceptScore W2380015812C147597530 @default.
- W2380015812 hasConceptScore W2380015812C147789679 @default.
- W2380015812 hasConceptScore W2380015812C161790260 @default.
- W2380015812 hasConceptScore W2380015812C178790620 @default.
- W2380015812 hasConceptScore W2380015812C185592680 @default.
- W2380015812 hasConceptScore W2380015812C22994065 @default.
- W2380015812 hasConceptScore W2380015812C2991951333 @default.
- W2380015812 hasConceptScore W2380015812C32909587 @default.
- W2380015812 hasConceptScore W2380015812C65024703 @default.
- W2380015812 hasConceptScore W2380015812C89031862 @default.
- W2380015812 hasConceptScore W2380015812C95121573 @default.
- W2380015812 hasLocation W23800158121 @default.
- W2380015812 hasOpenAccess W2380015812 @default.
- W2380015812 hasPrimaryLocation W23800158121 @default.
- W2380015812 hasRelatedWork W1546285962 @default.
- W2380015812 hasRelatedWork W1992113544 @default.
- W2380015812 hasRelatedWork W2014384346 @default.
- W2380015812 hasRelatedWork W2028270203 @default.
- W2380015812 hasRelatedWork W2032869781 @default.
- W2380015812 hasRelatedWork W2034393369 @default.
- W2380015812 hasRelatedWork W2042355896 @default.
- W2380015812 hasRelatedWork W2044588481 @default.
- W2380015812 hasRelatedWork W2053972978 @default.
- W2380015812 hasRelatedWork W2070205828 @default.
- W2380015812 hasRelatedWork W2095025164 @default.
- W2380015812 hasRelatedWork W2104350809 @default.
- W2380015812 hasRelatedWork W2319364365 @default.
- W2380015812 hasRelatedWork W2362500783 @default.
- W2380015812 hasRelatedWork W2366823052 @default.
- W2380015812 hasRelatedWork W2377835484 @default.
- W2380015812 hasRelatedWork W2378554471 @default.
- W2380015812 hasRelatedWork W2388674173 @default.
- W2380015812 hasRelatedWork W2392123506 @default.
- W2380015812 hasRelatedWork W2782599102 @default.
- W2380015812 isParatext "false" @default.
- W2380015812 isRetracted "false" @default.
- W2380015812 magId "2380015812" @default.
- W2380015812 workType "article" @default.