Matches in SemOpenAlex for { <https://semopenalex.org/work/W2080656415> ?p ?o ?g. }
Showing items 1 to 91 of
91
with 100 items per page.
- W2080656415 endingPage "485" @default.
- W2080656415 startingPage "480" @default.
- W2080656415 abstract "Configurations of C 60 fullerene derivatives (C 60 COOCH 2 , C 60 COOHCH 3 ) are optimized using B3LYP method at 6–31G* level. The calculated charge distributions by Natural Population Analysis show that the charge transfers exist between the functionalized group and parent C 60 . Then, the excited state properties of title species are calculated by the time-dependent density functional theory. It is shown that the fullerene derivatives make a small red shift of the absorption spectra in comparison with the C 60 cage itself and the calculated electronic absorption spectra are in good agreements with their observed values." @default.
- W2080656415 created "2016-06-24" @default.
- W2080656415 creator A5043520353 @default.
- W2080656415 creator A5044628568 @default.
- W2080656415 creator A5045538229 @default.
- W2080656415 creator A5057846845 @default.
- W2080656415 creator A5068614107 @default.
- W2080656415 creator A5084030481 @default.
- W2080656415 date "2003-10-01" @default.
- W2080656415 modified "2023-09-26" @default.
- W2080656415 title "Theoretical studies on photophysical properties of fullerene and its two derivatives (C60, C60COOCH2, C60COOHCH3)" @default.
- W2080656415 cites W135867663 @default.
- W2080656415 cites W1971612216 @default.
- W2080656415 cites W1978754056 @default.
- W2080656415 cites W1987415128 @default.
- W2080656415 cites W1988708850 @default.
- W2080656415 cites W1992066963 @default.
- W2080656415 cites W2004535303 @default.
- W2080656415 cites W2006947798 @default.
- W2080656415 cites W2010607740 @default.
- W2080656415 cites W2011079470 @default.
- W2080656415 cites W2011188705 @default.
- W2080656415 cites W2029697721 @default.
- W2080656415 cites W2063663126 @default.
- W2080656415 cites W2068228867 @default.
- W2080656415 cites W2069197437 @default.
- W2080656415 cites W2118525665 @default.
- W2080656415 cites W2143981217 @default.
- W2080656415 doi "https://doi.org/10.1016/j.cplett.2003.09.060" @default.
- W2080656415 hasPublicationYear "2003" @default.
- W2080656415 type Work @default.
- W2080656415 sameAs 2080656415 @default.
- W2080656415 citedByCount "11" @default.
- W2080656415 crossrefType "journal-article" @default.
- W2080656415 hasAuthorship W2080656415A5043520353 @default.
- W2080656415 hasAuthorship W2080656415A5044628568 @default.
- W2080656415 hasAuthorship W2080656415A5045538229 @default.
- W2080656415 hasAuthorship W2080656415A5057846845 @default.
- W2080656415 hasAuthorship W2080656415A5068614107 @default.
- W2080656415 hasAuthorship W2080656415A5084030481 @default.
- W2080656415 hasConcept C119824511 @default.
- W2080656415 hasConcept C121332964 @default.
- W2080656415 hasConcept C125287762 @default.
- W2080656415 hasConcept C147597530 @default.
- W2080656415 hasConcept C152365726 @default.
- W2080656415 hasConcept C159985019 @default.
- W2080656415 hasConcept C162862793 @default.
- W2080656415 hasConcept C178790620 @default.
- W2080656415 hasConcept C181500209 @default.
- W2080656415 hasConcept C184779094 @default.
- W2080656415 hasConcept C185592680 @default.
- W2080656415 hasConcept C188082385 @default.
- W2080656415 hasConcept C192562407 @default.
- W2080656415 hasConcept C4839761 @default.
- W2080656415 hasConcept C62520636 @default.
- W2080656415 hasConceptScore W2080656415C119824511 @default.
- W2080656415 hasConceptScore W2080656415C121332964 @default.
- W2080656415 hasConceptScore W2080656415C125287762 @default.
- W2080656415 hasConceptScore W2080656415C147597530 @default.
- W2080656415 hasConceptScore W2080656415C152365726 @default.
- W2080656415 hasConceptScore W2080656415C159985019 @default.
- W2080656415 hasConceptScore W2080656415C162862793 @default.
- W2080656415 hasConceptScore W2080656415C178790620 @default.
- W2080656415 hasConceptScore W2080656415C181500209 @default.
- W2080656415 hasConceptScore W2080656415C184779094 @default.
- W2080656415 hasConceptScore W2080656415C185592680 @default.
- W2080656415 hasConceptScore W2080656415C188082385 @default.
- W2080656415 hasConceptScore W2080656415C192562407 @default.
- W2080656415 hasConceptScore W2080656415C4839761 @default.
- W2080656415 hasConceptScore W2080656415C62520636 @default.
- W2080656415 hasIssue "3-4" @default.
- W2080656415 hasLocation W20806564151 @default.
- W2080656415 hasOpenAccess W2080656415 @default.
- W2080656415 hasPrimaryLocation W20806564151 @default.
- W2080656415 hasRelatedWork W2009117565 @default.
- W2080656415 hasRelatedWork W2031797113 @default.
- W2080656415 hasRelatedWork W2049775414 @default.
- W2080656415 hasRelatedWork W2332121877 @default.
- W2080656415 hasRelatedWork W2550491661 @default.
- W2080656415 hasRelatedWork W2585095169 @default.
- W2080656415 hasRelatedWork W2604044575 @default.
- W2080656415 hasRelatedWork W2796435584 @default.
- W2080656415 hasRelatedWork W2921431615 @default.
- W2080656415 hasRelatedWork W3161715925 @default.
- W2080656415 hasVolume "380" @default.
- W2080656415 isParatext "false" @default.
- W2080656415 isRetracted "false" @default.
- W2080656415 magId "2080656415" @default.
- W2080656415 workType "article" @default.