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Intermixing at the Pentacene‐Fullerene Bilayer Interface: A Molecular Dynamics Study
Author(s) -
Fu YaoTsung,
Risko Chad,
Brédas JeanLuc
Publication year - 2013
Publication title -
advanced materials
Language(s) - English
Resource type - Journals
SCImago Journal Rank - 10.707
H-Index - 527
eISSN - 1521-4095
pISSN - 0935-9648
DOI - 10.1002/adma.201203412
Subject(s) - pentacene , materials science , bilayer , fullerene , molecular dynamics , miscibility , chemical physics , photovoltaic system , nanotechnology , organic solar cell , interface (matter) , acceptor , computational chemistry , membrane , condensed matter physics , polymer , organic chemistry , chemistry , physics , layer (electronics) , capillary number , capillary action , composite material , biology , thin film transistor , ecology , biochemistry
Molecular dynamics simulations of the pentacene‐C 60 donor–acceptor interface reveal the potential for miscibility and disorder in “simple” bilayer organic photovoltaic architectures . The results fall in line with growing evidence of morphological complexity at such interfaces, and will impact descriptions of the electronic processes taking place during the photovoltaic effect.