Structural and solvent dependence on the molecular and nonlinear optical properties of 10-octyl thiophene-based phenothiazine and substituted derivatives – a theoretical approach
This work presents an investigation on the structural and solvent dependence on the molecular, electronic and nonlinear optical properties of some conjugated organic molecules based on phenothiazine units using quantum chemical calculations with pure BLYP and hybrid B3LYP correlation with a high pol...
Main Authors: | Oluwatoba Emmanuel Oyeneyin, Isaiah Ajibade Adejoro, Babatunde Temitope Ogunyemi, Oluwaseun Timothy Esan |
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Format: | Article |
Language: | English |
Published: |
Taylor & Francis Group
2018-07-01
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Series: | Journal of Taibah University for Science |
Subjects: | |
Online Access: | http://dx.doi.org/10.1080/16583655.2018.1485274 |
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