1. Universidade do Minho
  2. Escola de Engenharia | School of Engineering
  3. Centro de Ciências e Tecnologias da Computação
  4. CCTC - Artigos em revistas internacionais
Utilize este identificador para referenciar este registo: https://hdl.handle.net/1822/34708

Registo completo
Campo DCValorIdioma
dc.contributor.authorMelle-Franco, M.por
dc.date.accessioned2015-04-07T08:36:55Z-
dc.date.available2015-04-07T08:36:55Z-
dc.date.issued2015-
dc.identifier.citationMelle-Franco, M. (2015). Uthrene, a radically new molecule? Chemical Communications, 51(25), 5387-5390. doi: 10.1039/c5cc01276g-
dc.identifier.issn1359-7345por
dc.identifier.urihttps://hdl.handle.net/1822/34708-
dc.description.abstractWe have studied uthrene with a large range of quantum chemical models. Uthrene is predicted to be naturally twisted and to possess a triplet ground state, making it the smallest non-planar polycyclic biradical that can be derived from graphene.por
dc.description.sponsorshipFundação para a Ciência e a Tecnologia (FCT)por
dc.description.sponsorshipThe present work was carried out with support by the Portuguese ‘‘Fundação para a Ciência e a Tecnologia’’ through the program Ciência 2008 and project scope UID/CEC/00319/2013, as well as with resources from the project SeARCH (Services and Advanced Research Computing with HTC/HPC clusters) funded under contract CONC-REEQ/ 443/2005. A visiting scholarship and computer time from the HPC-EUROPA2 project is also gratefully acknowledged.por
dc.language.isoengpor
dc.publisherRoyal Society of Chemistrypor
dc.relationinfo:eu-repo/grantAgreement/FCT/5876/147280/PT-
dc.rightsopenAccess-
dc.subjectPAHpor
dc.subjectChemistrypor
dc.subjectGraphenepor
dc.titleUthrene, a radically new molecule?por
dc.typearticlepor
dc.peerreviewedyespor
sdum.publicationstatuspublishedpor
oaire.citationStartPage5387por
oaire.citationEndPage5390por
oaire.citationIssue25por
oaire.citationTitleChemical Communicationspor
oaire.citationVolume51por
dc.identifier.doi10.1039/c5cc01276gpor
dc.subject.fosCiências Naturais::Ciências Químicaspor
dc.subject.wosScience & Technologypor
sdum.journalChemical Communicationspor
Aparece nas coleções:CCTC - Artigos em revistas internacionais

Ficheiros deste registo:
Ficheiro Descrição TamanhoFormato 
uthrene.pdf1,56 MBAdobe PDFVer/Abrir
Ver registo simples Sugerir correção Estatísticas

Citations

Altmetrics


Partilhe no FacebookPartilhe no TwitterPartilhe no DeliciousPartilhe no LinkedInPartilhe no DiggAdicionar ao Google BookmarksPartilhe no MySpacePartilhe no Orkut
Exporte no formato BibTex mendeley Exporte no formato Endnote Adicione ao seu ORCID