Experimental, Semi-theoretical, and Theoretical Electronic and Non-linear Optical Characteristics of ECBP
Yazarlar (4)
Prof. Dr. Emine TANIŞ Kırşehir Ahi Evran Üniversitesi, Türkiye
Prof. Dr. Emine BABUR ŞAŞ Kırşehir Ahi Evran Üniversitesi, Türkiye
Bayram Gündüz Malatya Turgut Özal Üniversitesi, Türkiye
Prof. Dr. Mustafa KURT Kırşehir Ahi Evran Üniversitesi, Türkiye
Makale Türü Açık Erişim Özgün Makale (SSCI, AHCI, SCI, SCI-Exp dergilerinde yayınlanan tam makale)
Dergi Adı Journal of Electronic Materials
Dergi ISSN 0361-5235 Wos Dergi Scopus Dergi
Dergi Tarandığı Indeksler SCI
Makale Dili İngilizce Basım Tarihi 06-2020
Kabul Tarihi 12-04-2026 Yayınlanma Tarihi
Cilt / Sayı / Sayfa 49 / 6 / 3928–3937 DOI 10.1007/s11664-020-08106-w
Makale Linki http://link.springer.com/10.1007/s11664-020-08106-w
Özet
The electronic properties of 4,4′-bis(3-ethyl-N-carbazolyl)-1,1′-biphenyl (ECBP) have been studied using time-dependent density functional theory. The non-linear optical (NLO) properties and dipole moments were investigated to understand the optical behavior of ECBP. Frontier molecular orbitals were determined to define the energetic properties of the title molecule. The total density of states, partial density of states, and overlap population electronic density of states of ECBP were calculated and analyzed. Experimental and semi-theoretical parameters such as the optical density, transmittance, absorbance band edge, optical bandgap, refractive index, incidence angle, and refraction angle of ECBP at 3 mM, 10 mM, 21 mM, and 70 mM were obtained. The results indicate that this molecule is a suitable material for NLO, optical, and optoelectronic devices.
Anahtar Kelimeler
ECBP molecule | electronic and non-linear optical properties | experimental | optoelectronic devices | semi-theoretical and theoretical studies
BM Sürdürülebilir Kalkınma Amaçları
Atıf Sayıları
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Scopus 1
Experimental, Semi-theoretical, and Theoretical Electronic and Non-linear Optical Characteristics of ECBP

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