Matches in SemOpenAlex for { <https://semopenalex.org/work/W1990552011> ?p ?o ?g. }
Showing items 1 to 84 of
84
with 100 items per page.
- W1990552011 endingPage "50" @default.
- W1990552011 startingPage "43" @default.
- W1990552011 abstract "A coupled-cluster study of the equilibrium geometry of propadienylidene (C3H2) is presented. Deviations between a recently reported experimental re structure and those computed at the CCSD(T)/cc-pVQZ and CCSD(T)/cc-pCVQZ levels are larger than expected. A closer analysis reveals that this discrepancy is due to inaccuracies in the cubic force field that was used to correct the measured rotational constants for vibrational effects. A satisfactory agreement between theory and experiment is obtained if the vibrational effects on the rotational constants are computed from harmonic and cubic force fields determined at either the CCSD(T)/cc-pVTZ and CCSD(T)/cc-pCVTZ levels. Revised values for the “experimental” re structure of propadienylidene are also given." @default.
- W1990552011 created "2016-06-24" @default.
- W1990552011 creator A5001279277 @default.
- W1990552011 creator A5027671553 @default.
- W1990552011 date "1999-08-01" @default.
- W1990552011 modified "2023-10-03" @default.
- W1990552011 title "The equilibrium structure of propadienylidene" @default.
- W1990552011 cites W1964281997 @default.
- W1990552011 cites W1968943197 @default.
- W1990552011 cites W1982274673 @default.
- W1990552011 cites W1994807189 @default.
- W1990552011 cites W1995580529 @default.
- W1990552011 cites W1998705691 @default.
- W1990552011 cites W2007466458 @default.
- W1990552011 cites W2012458244 @default.
- W1990552011 cites W2022049251 @default.
- W1990552011 cites W2022591290 @default.
- W1990552011 cites W2041192156 @default.
- W1990552011 cites W2050615737 @default.
- W1990552011 cites W2057953020 @default.
- W1990552011 cites W2062606596 @default.
- W1990552011 cites W2065100700 @default.
- W1990552011 cites W2069006374 @default.
- W1990552011 cites W2090541120 @default.
- W1990552011 cites W2092430365 @default.
- W1990552011 cites W2092930273 @default.
- W1990552011 cites W2136527880 @default.
- W1990552011 cites W2519321445 @default.
- W1990552011 doi "https://doi.org/10.1016/s0022-2860(99)00084-8" @default.
- W1990552011 hasPublicationYear "1999" @default.
- W1990552011 type Work @default.
- W1990552011 sameAs 1990552011 @default.
- W1990552011 citedByCount "21" @default.
- W1990552011 countsByYear W19905520112012 @default.
- W1990552011 countsByYear W19905520112014 @default.
- W1990552011 countsByYear W19905520112015 @default.
- W1990552011 countsByYear W19905520112016 @default.
- W1990552011 countsByYear W19905520112019 @default.
- W1990552011 countsByYear W19905520112023 @default.
- W1990552011 crossrefType "journal-article" @default.
- W1990552011 hasAuthorship W1990552011A5001279277 @default.
- W1990552011 hasAuthorship W1990552011A5027671553 @default.
- W1990552011 hasConcept C10803110 @default.
- W1990552011 hasConcept C121332964 @default.
- W1990552011 hasConcept C127934551 @default.
- W1990552011 hasConcept C178790620 @default.
- W1990552011 hasConcept C184779094 @default.
- W1990552011 hasConcept C185592680 @default.
- W1990552011 hasConcept C19637589 @default.
- W1990552011 hasConcept C2992321928 @default.
- W1990552011 hasConcept C32909587 @default.
- W1990552011 hasConcept C62520636 @default.
- W1990552011 hasConcept C97355855 @default.
- W1990552011 hasConceptScore W1990552011C10803110 @default.
- W1990552011 hasConceptScore W1990552011C121332964 @default.
- W1990552011 hasConceptScore W1990552011C127934551 @default.
- W1990552011 hasConceptScore W1990552011C178790620 @default.
- W1990552011 hasConceptScore W1990552011C184779094 @default.
- W1990552011 hasConceptScore W1990552011C185592680 @default.
- W1990552011 hasConceptScore W1990552011C19637589 @default.
- W1990552011 hasConceptScore W1990552011C2992321928 @default.
- W1990552011 hasConceptScore W1990552011C32909587 @default.
- W1990552011 hasConceptScore W1990552011C62520636 @default.
- W1990552011 hasConceptScore W1990552011C97355855 @default.
- W1990552011 hasLocation W19905520111 @default.
- W1990552011 hasOpenAccess W1990552011 @default.
- W1990552011 hasPrimaryLocation W19905520111 @default.
- W1990552011 hasRelatedWork W2000982785 @default.
- W1990552011 hasRelatedWork W2011289872 @default.
- W1990552011 hasRelatedWork W2025078334 @default.
- W1990552011 hasRelatedWork W2039715911 @default.
- W1990552011 hasRelatedWork W2043887473 @default.
- W1990552011 hasRelatedWork W2050622073 @default.
- W1990552011 hasRelatedWork W2056635696 @default.
- W1990552011 hasRelatedWork W2065475078 @default.
- W1990552011 hasRelatedWork W2084268135 @default.
- W1990552011 hasRelatedWork W2791796631 @default.
- W1990552011 hasVolume "485-486" @default.
- W1990552011 isParatext "false" @default.
- W1990552011 isRetracted "false" @default.
- W1990552011 magId "1990552011" @default.
- W1990552011 workType "article" @default.