{"status":"ok","message-type":"work","message-version":"1.0.0","message":{"indexed":{"date-parts":[[2026,2,11]],"date-time":"2026-02-11T20:09:22Z","timestamp":1770840562252,"version":"3.50.1"},"reference-count":58,"publisher":"American Chemical Society (ACS)","issue":"5","content-domain":{"domain":[],"crossmark-restriction":false},"short-container-title":["J. Phys. Chem. C"],"published-print":{"date-parts":[[2014,2,6]]},"DOI":"10.1021\/jp409583q","type":"journal-article","created":{"date-parts":[[2014,1,13]],"date-time":"2014-01-13T16:18:53Z","timestamp":1389629933000},"page":"2287-2297","source":"Crossref","is-referenced-by-count":13,"title":["Photocurrent Generation in Bulk vs Bilayer Devices: Quantum Treatment of Model Rubrene\/7,7,8,8-Tetracyanoquinodimethane Heterojunctions for Organic Solar Cells"],"prefix":"10.1021","volume":"118","author":[{"given":"Rui M.","family":"Pinto","sequence":"first","affiliation":[{"name":"INESC\rMN and IN, Rua Alves Redol No. 9, 1000-029 Lisboa, Portugal"},{"name":"CQFM, Instituto Superior T\u00e9cnico, Avenida Rovisco Pais, 1049-001 Lisboa, Portugal"}]}],"member":"316","published-online":{"date-parts":[[2014,1,23]]},"reference":[{"key":"ref1\/cit1","doi-asserted-by":"crossref","first-page":"1","DOI":"10.1002\/pip.2352","volume":"21","author":"Green M. A.","year":"2013","journal-title":"Prog. Photovoltaics"},{"key":"ref2\/cit2","doi-asserted-by":"crossref","first-page":"1446","DOI":"10.1038\/ncomms2411","volume":"4","author":"You J.","year":"2013","journal-title":"Nat. Commun."},{"key":"ref3\/cit3","doi-asserted-by":"crossref","first-page":"1324","DOI":"10.1021\/cr050149z","volume":"107","author":"G\u00fcnes S.","year":"2007","journal-title":"Chem. Rev."},{"key":"ref4\/cit4","doi-asserted-by":"crossref","first-page":"1789","DOI":"10.1126\/science.270.5243.1789","volume":"270","author":"Yu G.","year":"1995","journal-title":"Science"},{"key":"ref5\/cit5","doi-asserted-by":"crossref","first-page":"297","DOI":"10.1038\/nphoton.2009.69","volume":"3","author":"Park S. H.","year":"2009","journal-title":"Nat. Photonics"},{"key":"ref6\/cit6","doi-asserted-by":"crossref","first-page":"096401","DOI":"10.1088\/0034-4885\/73\/9\/096401","volume":"73","author":"Deibel C.","year":"2010","journal-title":"Rep. Prog. Phys."},{"key":"ref7\/cit7","doi-asserted-by":"crossref","first-page":"183","DOI":"10.1063\/1.96937","volume":"48","author":"Tang C. W.","year":"1986","journal-title":"Appl. Phys. Lett."},{"key":"ref8\/cit8","doi-asserted-by":"crossref","first-page":"20050","DOI":"10.1021\/jp9050897","volume":"113","author":"Ayzner A. L.","year":"2009","journal-title":"J. Phys. Chem. C"},{"key":"ref9\/cit9","doi-asserted-by":"crossref","first-page":"66","DOI":"10.1002\/adma.200400617","volume":"17","author":"Xue J.","year":"2005","journal-title":"Adv. Mater."},{"key":"ref10\/cit10","doi-asserted-by":"crossref","first-page":"947","DOI":"10.1021\/jz1000819","volume":"1","author":"Venkataraman D.","year":"2010","journal-title":"J. Phys. Chem. Lett."},{"key":"ref11\/cit11","doi-asserted-by":"crossref","first-page":"204","DOI":"10.1016\/j.solmat.2011.11.042","volume":"99","author":"Ray B.","year":"2012","journal-title":"Sol. Energy Mater. Sol. Cells"},{"key":"ref12\/cit12","doi-asserted-by":"crossref","first-page":"37","DOI":"10.1038\/nmat1285","volume":"4","author":"Yang F.","year":"2004","journal-title":"Nat. Mater."},{"key":"ref13\/cit13","doi-asserted-by":"crossref","first-page":"9281","DOI":"10.1021\/ja9007722","volume":"131","author":"Perez M. D.","year":"2009","journal-title":"J. Am. Chem. Soc."},{"key":"ref14\/cit14","doi-asserted-by":"crossref","first-page":"1842","DOI":"10.1038\/ncomms2890","volume":"4","author":"Alves H.","year":"2013","journal-title":"Nat. Commun."},{"key":"ref15\/cit15","doi-asserted-by":"crossref","first-page":"938","DOI":"10.1038\/nmat2872","volume":"9","author":"Najafov H.","year":"2010","journal-title":"Nat. Mater."},{"key":"ref16\/cit16","doi-asserted-by":"crossref","first-page":"599","DOI":"10.1103\/RevModPhys.65.599","volume":"65","author":"Marcus R. A.","year":"1993","journal-title":"Rev. Mod. Phys."},{"key":"ref17\/cit17","doi-asserted-by":"crossref","first-page":"4157","DOI":"10.1063\/1.447243","volume":"80","author":"Braun C. L.","year":"1984","journal-title":"J. Chem. Phys."},{"key":"ref18\/cit18","doi-asserted-by":"crossref","first-page":"086602","DOI":"10.1103\/PhysRevLett.93.086602","volume":"93","author":"Podzorov V.","year":"2004","journal-title":"Phys. Rev. Lett."},{"key":"ref19\/cit19","doi-asserted-by":"crossref","first-page":"574","DOI":"10.1038\/nmat2205","volume":"7","author":"Alves H.","year":"2008","journal-title":"Nat. Mater."},{"key":"ref20\/cit20","doi-asserted-by":"crossref","first-page":"23957","DOI":"10.1021\/jp308720d","volume":"116","author":"Tsutsumi J.","year":"2012","journal-title":"J. Phys. Chem. C"},{"key":"ref21\/cit21","doi-asserted-by":"crossref","first-page":"6077","DOI":"10.1021\/ja042390l","volume":"127","author":"Lemaur V.","year":"2005","journal-title":"J. Am. Chem. Soc."},{"key":"ref22\/cit22","doi-asserted-by":"crossref","first-page":"3429","DOI":"10.1021\/jp711186j","volume":"112","author":"Kawatsu T.","year":"2008","journal-title":"J. Phys. Chem. C"},{"key":"ref23\/cit23","doi-asserted-by":"crossref","first-page":"15777","DOI":"10.1021\/ja905975w","volume":"131","author":"Yi Y.","year":"2009","journal-title":"J. Am. Chem. Soc."},{"key":"ref24\/cit24","doi-asserted-by":"crossref","first-page":"2406","DOI":"10.1021\/jp109130y","volume":"115","author":"Liu T.","year":"2011","journal-title":"J. Phys. Chem. C"},{"key":"ref25\/cit25","doi-asserted-by":"crossref","first-page":"932","DOI":"10.1107\/S0365110X65002256","volume":"18","author":"Long R. E.","year":"1965","journal-title":"Acta Crystallogr."},{"key":"ref26\/cit26","doi-asserted-by":"crossref","first-page":"330","DOI":"10.1107\/S0108768106003053","volume":"62","author":"Jurchescu O. D.","year":"2006","journal-title":"Acta Crystallogr., Sect. B: Struct. Sci."},{"key":"ref27\/cit27","doi-asserted-by":"crossref","first-page":"1740","DOI":"10.1021\/ar9000923","volume":"42","author":"Heremans P.","year":"2009","journal-title":"Acc. Chem. Res."},{"key":"ref28\/cit28","doi-asserted-by":"crossref","first-page":"182","DOI":"10.1039\/C3TA13107F","volume":"2","author":"Vasilopoulou M.","year":"2014","journal-title":"J. Mater. Chem. A"},{"key":"ref29\/cit29","doi-asserted-by":"crossref","first-page":"954","DOI":"10.1002\/aenm.201100204","volume":"1","author":"Beiley Z. M.","year":"2011","journal-title":"Adv. Energy Mater."},{"key":"ref30\/cit30","doi-asserted-by":"crossref","first-page":"51","DOI":"10.1016\/j.cplett.2004.06.011","volume":"393","author":"Yanai T.","year":"2004","journal-title":"Chem. Phys. Lett."},{"key":"ref31\/cit31","doi-asserted-by":"crossref","first-page":"154104","DOI":"10.1063\/1.3382344","volume":"132","author":"Grimme S.","year":"2010","journal-title":"J. Chem. Phys."},{"key":"ref32\/cit32","doi-asserted-by":"crossref","unstructured":"Gordon, M. S.; Schmidt, M. W.Advances in Electronic Structure Theory: GAMESS a Decade Later;Elsevier:Amsterdam, 2005; pp1167\u20131189.","DOI":"10.1016\/B978-044451719-7\/50084-6"},{"key":"ref33\/cit33","doi-asserted-by":"crossref","first-page":"4538","DOI":"10.1039\/c3cp50438g","volume":"15","author":"Savoie B. M.","year":"2013","journal-title":"Phys. Chem. Chem. Phys."},{"key":"ref34\/cit34","doi-asserted-by":"crossref","first-page":"1479","DOI":"10.1039\/c0jm02467h","volume":"21","author":"Yi Y.","year":"2011","journal-title":"J. Mater. Chem."},{"key":"ref35\/cit35","doi-asserted-by":"crossref","first-page":"15879","DOI":"10.1021\/jp401990z","volume":"117","author":"Song P.","year":"2013","journal-title":"J. Phys. Chem. C"},{"key":"ref36\/cit36","doi-asserted-by":"crossref","first-page":"591","DOI":"10.1021\/cm1023426","volume":"23","author":"Beljonne D.","year":"2011","journal-title":"Chem. Mater."},{"key":"ref37\/cit37","doi-asserted-by":"crossref","first-page":"677","DOI":"10.1021\/ja00237a007","volume":"109","author":"Nelsen S. F.","year":"1987","journal-title":"J. Am. Chem. Soc."},{"key":"ref38\/cit38","doi-asserted-by":"crossref","first-page":"941","DOI":"10.1021\/jz1001049","volume":"1","author":"McMahon D. P.","year":"2010","journal-title":"J. Phys. Chem. Lett."},{"key":"ref39\/cit39","doi-asserted-by":"crossref","first-page":"14894","DOI":"10.1021\/ja054257e","volume":"127","author":"Senthilkumar K.","year":"2005","journal-title":"J. Am. Chem. Soc."},{"key":"ref40\/cit40","doi-asserted-by":"crossref","first-page":"509","DOI":"10.1021\/ar800153f","volume":"42","author":"Hsu C.-P.","year":"2009","journal-title":"Acc. Chem. Res."},{"key":"ref41\/cit41","doi-asserted-by":"crossref","first-page":"11103","DOI":"10.1039\/c002337j","volume":"12","author":"Baumeier B.","year":"2010","journal-title":"Phys. Chem. Chem. Phys."},{"key":"ref42\/cit42","doi-asserted-by":"crossref","first-page":"085205","DOI":"10.1103\/PhysRevB.72.085205","volume":"72","author":"Koster L. J. A.","year":"2005","journal-title":"Phys. Rev. B"},{"key":"ref43\/cit43","doi-asserted-by":"crossref","first-page":"093511","DOI":"10.1063\/1.2181635","volume":"88","author":"Koster L.","year":"2006","journal-title":"Appl. Phys. Lett."},{"key":"ref44\/cit44","first-page":"122","volume":"28","author":"Langevin P.","year":"1903","journal-title":"Ann. Chim. Phys."},{"key":"ref45\/cit45","doi-asserted-by":"crossref","first-page":"839","DOI":"10.1002\/jcc.20823","volume":"29","author":"O\u2019Boyle N. M.","year":"2008","journal-title":"J. Comput. Chem."},{"key":"ref46\/cit46","doi-asserted-by":"crossref","first-page":"2068","DOI":"10.1021\/ct200203k","volume":"7","author":"Arago J.","year":"2011","journal-title":"J. Chem. Theory Comput."},{"key":"ref47\/cit47","doi-asserted-by":"crossref","first-page":"149","DOI":"10.1016\/j.cplett.2011.10.001","volume":"516","author":"Pinto R. M.","year":"2011","journal-title":"Chem. Phys. Lett."},{"key":"ref48\/cit48","doi-asserted-by":"crossref","first-page":"1621","DOI":"10.1039\/f29817701621","volume":"77","author":"Sato N.","year":"1981","journal-title":"J. Chem. Soc., Faraday Trans. 2"},{"key":"ref49\/cit49","doi-asserted-by":"crossref","first-page":"394","DOI":"10.1016\/j.orgel.2010.11.025","volume":"12","author":"Schwenn P.","year":"2011","journal-title":"Org. Electron."},{"key":"ref50\/cit50","doi-asserted-by":"crossref","first-page":"3689","DOI":"10.1002\/adma.200900276","volume":"21","author":"Kaji T.","year":"2009","journal-title":"Adv. Mater."},{"key":"ref51\/cit51","doi-asserted-by":"crossref","first-page":"309","DOI":"10.1007\/s00339-008-5021-1","volume":"95","author":"Kanai K.","year":"2009","journal-title":"Appl. Phys. A: Mater. Sci. Process."},{"key":"ref52\/cit52","doi-asserted-by":"crossref","first-page":"4325","DOI":"10.1063\/1.433743","volume":"66","author":"Compton R.","year":"1977","journal-title":"J. Chem. Phys."},{"key":"ref53\/cit53","doi-asserted-by":"crossref","first-page":"901","DOI":"10.1002\/adma.201103262","volume":"24","author":"Duhm S.","year":"2012","journal-title":"Adv. Mater."},{"key":"ref54\/cit54","doi-asserted-by":"crossref","first-page":"1246","DOI":"10.1002\/aenm.201200103","volume":"2","author":"Koster L.","year":"2012","journal-title":"Adv. Energy Mater."},{"key":"ref55\/cit55","doi-asserted-by":"crossref","first-page":"4410","DOI":"10.1039\/c1ee01663f","volume":"4","author":"Servaites J. D.","year":"2011","journal-title":"Energy Environ. Sci."},{"key":"ref56\/cit56","doi-asserted-by":"crossref","first-page":"580","DOI":"10.1002\/qua.24006","volume":"113","author":"Id\u00e9 J.","year":"2013","journal-title":"Int. J. Quantum Chem."},{"key":"ref57\/cit57","doi-asserted-by":"crossref","first-page":"174708","DOI":"10.1063\/1.4763542","volume":"137","author":"Van Regemorter T.","year":"2012","journal-title":"J. Chem. Phys."},{"key":"ref58\/cit58","doi-asserted-by":"crossref","first-page":"12106","DOI":"10.1021\/ja203235z","volume":"133","author":"Holcombe T. W.","year":"2011","journal-title":"J. Am. Chem. Soc."}],"container-title":["The Journal of Physical Chemistry C"],"original-title":[],"language":"en","link":[{"URL":"https:\/\/pubs.acs.org\/doi\/pdf\/10.1021\/jp409583q","content-type":"unspecified","content-version":"vor","intended-application":"similarity-checking"}],"deposited":{"date-parts":[[2023,4,14]],"date-time":"2023-04-14T12:54:25Z","timestamp":1681476865000},"score":1,"resource":{"primary":{"URL":"https:\/\/pubs.acs.org\/doi\/10.1021\/jp409583q"}},"subtitle":[],"short-title":[],"issued":{"date-parts":[[2014,1,23]]},"references-count":58,"journal-issue":{"issue":"5","published-print":{"date-parts":[[2014,2,6]]}},"alternative-id":["10.1021\/jp409583q"],"URL":"https:\/\/doi.org\/10.1021\/jp409583q","relation":{},"ISSN":["1932-7447","1932-7455"],"issn-type":[{"value":"1932-7447","type":"print"},{"value":"1932-7455","type":"electronic"}],"subject":[],"published":{"date-parts":[[2014,1,23]]}}}