Prediction of structural, vibrational and nonlinear optical properties of small organic conjugated molecules derived from pyridine

Published 2019 View Full Article

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Title
Prediction of structural, vibrational and nonlinear optical properties of small organic conjugated molecules derived from pyridine
Authors
Keywords
DFT, Electronic properties, Optical spectra, NBO, NLO properties
Journal
JOURNAL OF MOLECULAR STRUCTURE
Volume 1182, Issue -, Pages 131-140
Publisher
Elsevier BV
Online
2019-01-12
DOI
10.1016/j.molstruc.2019.01.043

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