شماره ركورد كنفرانس :
5328
عنوان مقاله :
The effect of electrode materials on I–V characteristics behavior of 2,2,6,6-tetramethyl 3,5-heptanedione (a β-diketone) as molecular switch
پديدآورندگان :
Eslah Aliabadi Mohammad eslah.khosravi@gmail.com Department of Chemistry, Faculty of Science, Ferdowsi University of Mashhad, Mashhad, Iran , vakilia Mohammad vakili-m@um.ac.ir Department of Chemistry, Faculty of Science, Ferdowsi University of Mashhad, Mashhad, Iran , Kanaani Ayoub A.kanaani@yahoo.com School of Chemistry, Damghan University,Damghan,Iran , Darugar Vahid Reza vahidrezadarugar@mail.um.ac.ir Department of Chemistry, Faculty of Science, Ferdowsi University of Mashhad, Mashhad, Iran
كليدواژه :
Switching behavior , β diketone , Electronic transport , DFT NEGF
عنوان كنفرانس :
بيست و سومين كنفرانس شيمي فيزيك انجمن شيمي ايران
چكيده فارسي :
In this research, using nonequilibrium green’s function (NEGF) integrated with density functional theory (DFT). We investigated the electronic transport properties of a β-diketone, 2,2,6,6- tetramethyl-3,5-heptanedione,as molecular wire.