Pregled bibliografske jedinice broj: 378905
Controlling the conductance of pi-conjugated molecules
Controlling the conductance of pi-conjugated molecules // International Workshop on Nonequilibrium Nanostructures : Book of Abstracts / Helm, M. ; Lipavsky P. ; Morawetz K. (ur.).
Dresden, 2008. (pozvano predavanje, međunarodna recenzija, sažetak, znanstveni)
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Naslov
Controlling the conductance of pi-conjugated molecules
Autori
Crljen, Željko
Vrsta, podvrsta i kategorija rada
Sažeci sa skupova, sažetak, znanstveni
Izvornik
International Workshop on Nonequilibrium Nanostructures : Book of Abstracts
/ Helm, M. ; Lipavsky P. ; Morawetz K. - Dresden, 2008
Skup
International Workshop on Nonequilibrium Nanostructures
Mjesto i datum
Dresden, Njemačka, 01.12.2008. - 06.12.2008
Vrsta sudjelovanja
Pozvano predavanje
Vrsta recenzije
Međunarodna recenzija
Ključne riječi
conductance; dft; molecular junctions; oligomer
Sažetak
We performed series of calculations of the conductance of certain classes of pi-conjugated molecules. We used a full self-consistent ab initio method based on the density functional theory and nonequilibrium Green's function technique. In the low bias regime we found that the conductance in Tour wires and OPV molecules, shows the decrease proportional to the number of benzene rings in the molecule and nonlinearity with the length of the molecule.
Izvorni jezik
Engleski
Znanstvena područja
Fizika
POVEZANOST RADA
Projekti:
098-0352828-3118 - Elektronska svojstva hibridnih nanostruktura (Crljen, Željko, MZOS ) ( CroRIS)
Ustanove:
Institut "Ruđer Bošković", Zagreb
Profili:
Željko Crljen
(autor)
