Matches in SemOpenAlex for { <https://semopenalex.org/work/W2004187727> ?p ?o ?g. }
- W2004187727 endingPage "1163" @default.
- W2004187727 startingPage "1155" @default.
- W2004187727 abstract "Abstract The electronic structure of doped‐oligoaniline with various dopants is investigated by means of DFT method. After doping by hydrochloric acid (HCl) and camphorsulfonic acid (HCSA), the alternation of bond‐lengths is decreased and the co‐planarity of adjacent aromatic rings is increased. The π‐conjugating effect is increased in the electronic nature of Ph‐N system because the electrons can be delocalized along the backbone of oligoaniline where the hydrogen bonds as a bridge transfer the electrons. The electronic structure of polaron and bipolaron conformation and their relative stability is discussed, indicating that the preferable conformation is dependant on various dopants. The calculation results reveal that there is a relatively stronger interaction between the organic dopant of HCSA and N atoms of PANI, and more charge transfer between PANI and HCSA is a reason for the fact that the conductivity of HCSA‐doped PANI is higher than that of HCl‐doped PANI. The doping mechanism is proposed based on the calculation results. © 2008 Wiley Periodicals, Inc. Int J Quantum Chem, 2008" @default.
- W2004187727 created "2016-06-24" @default.
- W2004187727 creator A5034011532 @default.
- W2004187727 creator A5041398286 @default.
- W2004187727 creator A5044490638 @default.
- W2004187727 creator A5048880756 @default.
- W2004187727 creator A5088420709 @default.
- W2004187727 date "2008-01-01" @default.
- W2004187727 modified "2023-10-18" @default.
- W2004187727 title "Electronic structure of oligoaniline doped by inorganic and organic acids" @default.
- W2004187727 cites W1965948947 @default.
- W2004187727 cites W1976684281 @default.
- W2004187727 cites W1988435453 @default.
- W2004187727 cites W1989329024 @default.
- W2004187727 cites W1996056083 @default.
- W2004187727 cites W2001362777 @default.
- W2004187727 cites W2002465835 @default.
- W2004187727 cites W2012084615 @default.
- W2004187727 cites W2017852426 @default.
- W2004187727 cites W2018446304 @default.
- W2004187727 cites W2023848105 @default.
- W2004187727 cites W2027648272 @default.
- W2004187727 cites W2030127286 @default.
- W2004187727 cites W2032152154 @default.
- W2004187727 cites W2033399365 @default.
- W2004187727 cites W2042111116 @default.
- W2004187727 cites W2042965938 @default.
- W2004187727 cites W2046256458 @default.
- W2004187727 cites W2046671229 @default.
- W2004187727 cites W2047734159 @default.
- W2004187727 cites W2050143764 @default.
- W2004187727 cites W2052257337 @default.
- W2004187727 cites W2056899123 @default.
- W2004187727 cites W2057082616 @default.
- W2004187727 cites W2081829151 @default.
- W2004187727 cites W2085418844 @default.
- W2004187727 cites W2087274101 @default.
- W2004187727 cites W2090964495 @default.
- W2004187727 cites W2091175041 @default.
- W2004187727 cites W2952334033 @default.
- W2004187727 cites W3023438842 @default.
- W2004187727 doi "https://doi.org/10.1002/qua.21593" @default.
- W2004187727 hasPublicationYear "2008" @default.
- W2004187727 type Work @default.
- W2004187727 sameAs 2004187727 @default.
- W2004187727 citedByCount "13" @default.
- W2004187727 countsByYear W20041877272013 @default.
- W2004187727 countsByYear W20041877272015 @default.
- W2004187727 countsByYear W20041877272018 @default.
- W2004187727 countsByYear W20041877272020 @default.
- W2004187727 countsByYear W20041877272022 @default.
- W2004187727 crossrefType "journal-article" @default.
- W2004187727 hasAuthorship W2004187727A5034011532 @default.
- W2004187727 hasAuthorship W2004187727A5041398286 @default.
- W2004187727 hasAuthorship W2004187727A5044490638 @default.
- W2004187727 hasAuthorship W2004187727A5048880756 @default.
- W2004187727 hasAuthorship W2004187727A5088420709 @default.
- W2004187727 hasConcept C121332964 @default.
- W2004187727 hasConcept C147120987 @default.
- W2004187727 hasConcept C147597530 @default.
- W2004187727 hasConcept C159467904 @default.
- W2004187727 hasConcept C178790620 @default.
- W2004187727 hasConcept C185592680 @default.
- W2004187727 hasConcept C191952053 @default.
- W2004187727 hasConcept C192562407 @default.
- W2004187727 hasConcept C2781436544 @default.
- W2004187727 hasConcept C49040817 @default.
- W2004187727 hasConcept C57863236 @default.
- W2004187727 hasConcept C62520636 @default.
- W2004187727 hasConcept C64127065 @default.
- W2004187727 hasConcept C70050531 @default.
- W2004187727 hasConcept C86025842 @default.
- W2004187727 hasConceptScore W2004187727C121332964 @default.
- W2004187727 hasConceptScore W2004187727C147120987 @default.
- W2004187727 hasConceptScore W2004187727C147597530 @default.
- W2004187727 hasConceptScore W2004187727C159467904 @default.
- W2004187727 hasConceptScore W2004187727C178790620 @default.
- W2004187727 hasConceptScore W2004187727C185592680 @default.
- W2004187727 hasConceptScore W2004187727C191952053 @default.
- W2004187727 hasConceptScore W2004187727C192562407 @default.
- W2004187727 hasConceptScore W2004187727C2781436544 @default.
- W2004187727 hasConceptScore W2004187727C49040817 @default.
- W2004187727 hasConceptScore W2004187727C57863236 @default.
- W2004187727 hasConceptScore W2004187727C62520636 @default.
- W2004187727 hasConceptScore W2004187727C64127065 @default.
- W2004187727 hasConceptScore W2004187727C70050531 @default.
- W2004187727 hasConceptScore W2004187727C86025842 @default.
- W2004187727 hasIssue "6" @default.
- W2004187727 hasLocation W20041877271 @default.
- W2004187727 hasOpenAccess W2004187727 @default.
- W2004187727 hasPrimaryLocation W20041877271 @default.
- W2004187727 hasRelatedWork W1483250569 @default.
- W2004187727 hasRelatedWork W1996509551 @default.
- W2004187727 hasRelatedWork W2075756961 @default.
- W2004187727 hasRelatedWork W2081789258 @default.
- W2004187727 hasRelatedWork W2093355265 @default.
- W2004187727 hasRelatedWork W2148383233 @default.
- W2004187727 hasRelatedWork W2152955146 @default.