Experimental and computational study of triphenylamine dyes for photovoltaic cell applications
     
Yazarlar (2)
Prof. Dr. Emine BABUR ŞAŞ Kırşehir Ahi Evran Üniversitesi, Türkiye
Mustafa Can
İzmir Kâtip Çelebi Üniversitesi, Türkiye
Makale Türü Özgün Makale (SSCI, AHCI, SCI, SCI-Exp dergilerinde yayınlanan tam makale)
Dergi Adı EPJ Applied Physics (Q4)
Dergi ISSN 1286-0042 Wos Dergi Scopus Dergi
Dergi Tarandığı Indeksler SCI-Expanded
Makale Dili Türkçe Basım Tarihi 03-2023
Cilt / Sayı / Sayfa 98 / 1 / – DOI 10.1051/epjap/2023220283
Makale Linki http://dx.doi.org/10.1051/epjap/2023220283
Özet
We investigate a new family of the triphenylamine dyes by the help of quantum physics computations relaying on density functional theory (DFT) including time dependent-density functional theory (TD-DFT) calculations. We examine the distributions of molecular orbitals, the light collection efficiency, the absorption properties, the oscillator forces, the electronic excitation energy, and the injection driving forces. Among others, we reveal that the organic dyes involve a narrow band gap and good optical behaviors. Moreover, we approach the photovoltaic features of such novel materials. We find that they exhibit the capacity to inject the electrons into the conduction band. We expect that the obtained results could support the applications of such materials in solar energy productions.
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