FRINK Linked Data Fragments server

Matches in SemOpenAlex for { <https://semopenalex.org/work/W2012159162> ?p ?o ?g. }

• W2012159162 endingPage "14862" @default.
• W2012159162 startingPage "14857" @default.
• W2012159162 abstract "We use quantum mechanical (QM) methods to interpret the charge transport properties of the self-assembled poly-3-hexylthiophene (P3HT) molecules along the intrachain and interchain directions. Our approach is illustrated by a hopping transport model, in which we examine the variation of the electron-coupling strength (transfer integral) with the torsional angle and the intermolecular distance between two adjacent thiophene segments. We also simulate the packed P3HT structures at various values of temperature and regioregularity via the molecular dynamics (MD) simulations. The MD results indicate that with decreasing the molecular regioregularity and/or increasing temperature, the P3HT backbone chains experience a larger distortion of the thiophene rings out of coplanarity, and thus the charge mobility along the main chains is reduced. However, as long as the P3HT molecules remain in the ordered lamellar state due to the presence of the pi-pi interaction, the resultant mobility along the pi-pi interchain direction is still significantly less than that along the intrachain direction. Accordingly, the main charge transfer route within the P3HT ordered domains is along the intrachains instead of the interchains." @default.
• W2012159162 created "2016-06-24" @default.
• W2012159162 creator A5080533852 @default.
• W2012159162 creator A5080657659 @default.
• W2012159162 date "2008-10-31" @default.
• W2012159162 modified "2023-10-17" @default.
• W2012159162 title "A Theoretical Study of the Charge Transfer Behavior of the Highly Regioregular Poly-3-hexylthiophene in the Ordered State" @default.
• W2012159162 cites W180160316 @default.
• W2012159162 cites W1964645805 @default.
• W2012159162 cites W1964781698 @default.
• W2012159162 cites W1965188415 @default.
• W2012159162 cites W1973416260 @default.
• W2012159162 cites W1976849993 @default.
• W2012159162 cites W1984637234 @default.
• W2012159162 cites W1988816903 @default.
• W2012159162 cites W1992028426 @default.
• W2012159162 cites W1996291528 @default.
• W2012159162 cites W2000813860 @default.
• W2012159162 cites W2006571183 @default.
• W2012159162 cites W2014657621 @default.
• W2012159162 cites W2025177295 @default.
• W2012159162 cites W2036898431 @default.
• W2012159162 cites W2052605469 @default.
• W2012159162 cites W2064521809 @default.
• W2012159162 cites W2067443126 @default.
• W2012159162 cites W2074573245 @default.
• W2012159162 cites W2077416151 @default.
• W2012159162 cites W2081616310 @default.
• W2012159162 cites W2086922619 @default.
• W2012159162 cites W2094405563 @default.
• W2012159162 cites W2102521642 @default.
• W2012159162 cites W2103204764 @default.
• W2012159162 cites W2116650273 @default.
• W2012159162 cites W2141517543 @default.
• W2012159162 cites W2142910748 @default.
• W2012159162 cites W2158621641 @default.
• W2012159162 cites W264642757 @default.
• W2012159162 cites W3004824493 @default.
• W2012159162 cites W592658746 @default.
• W2012159162 doi "https://doi.org/10.1021/jp806967x" @default.
• W2012159162 hasPubMedId "https://pubmed.ncbi.nlm.nih.gov/18973359" @default.
• W2012159162 hasPublicationYear "2008" @default.
• W2012159162 type Work @default.
• W2012159162 sameAs 2012159162 @default.
• W2012159162 citedByCount "147" @default.
• W2012159162 countsByYear W20121591622012 @default.
• W2012159162 countsByYear W20121591622013 @default.
• W2012159162 countsByYear W20121591622014 @default.
• W2012159162 countsByYear W20121591622015 @default.
• W2012159162 countsByYear W20121591622016 @default.
• W2012159162 countsByYear W20121591622017 @default.
• W2012159162 countsByYear W20121591622018 @default.
• W2012159162 countsByYear W20121591622019 @default.
• W2012159162 countsByYear W20121591622020 @default.
• W2012159162 countsByYear W20121591622021 @default.
• W2012159162 countsByYear W20121591622022 @default.
• W2012159162 countsByYear W20121591622023 @default.
• W2012159162 crossrefType "journal-article" @default.
• W2012159162 hasAuthorship W2012159162A5080533852 @default.
• W2012159162 hasAuthorship W2012159162A5080657659 @default.
• W2012159162 hasConcept C121332964 @default.
• W2012159162 hasConcept C131584629 @default.
• W2012159162 hasConcept C147597530 @default.
• W2012159162 hasConcept C159467904 @default.
• W2012159162 hasConcept C166950319 @default.
• W2012159162 hasConcept C178790620 @default.
• W2012159162 hasConcept C185592680 @default.
• W2012159162 hasConcept C188082385 @default.
• W2012159162 hasConcept C191897082 @default.
• W2012159162 hasConcept C192562407 @default.
• W2012159162 hasConcept C2779953032 @default.
• W2012159162 hasConcept C32909587 @default.
• W2012159162 hasConcept C59593255 @default.
• W2012159162 hasConcept C62520636 @default.
• W2012159162 hasConcept C77851909 @default.
• W2012159162 hasConcept C8010536 @default.
• W2012159162 hasConceptScore W2012159162C121332964 @default.
• W2012159162 hasConceptScore W2012159162C131584629 @default.
• W2012159162 hasConceptScore W2012159162C147597530 @default.
• W2012159162 hasConceptScore W2012159162C159467904 @default.
• W2012159162 hasConceptScore W2012159162C166950319 @default.
• W2012159162 hasConceptScore W2012159162C178790620 @default.
• W2012159162 hasConceptScore W2012159162C185592680 @default.
• W2012159162 hasConceptScore W2012159162C188082385 @default.
• W2012159162 hasConceptScore W2012159162C191897082 @default.
• W2012159162 hasConceptScore W2012159162C192562407 @default.
• W2012159162 hasConceptScore W2012159162C2779953032 @default.
• W2012159162 hasConceptScore W2012159162C32909587 @default.
• W2012159162 hasConceptScore W2012159162C59593255 @default.
• W2012159162 hasConceptScore W2012159162C62520636 @default.
• W2012159162 hasConceptScore W2012159162C77851909 @default.
• W2012159162 hasConceptScore W2012159162C8010536 @default.
• W2012159162 hasIssue "47" @default.
• W2012159162 hasLocation W20121591621 @default.
• W2012159162 hasLocation W20121591622 @default.
• W2012159162 hasOpenAccess W2012159162 @default.
• W2012159162 hasPrimaryLocation W20121591621 @default.
• W2012159162 hasRelatedWork W1997448226 @default.

• next