Electronic structure, physico-chemical, linear and non linear optical properties analysis of coronene, 6B-, 6N-, 3B3N- substituted C24H12 using RHF, B3LYP and wB97XD methods
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Title
Electronic structure, physico-chemical, linear and non linear optical properties analysis of coronene, 6B-, 6N-, 3B3N- substituted C24H12 using RHF, B3LYP and wB97XD methods
Authors
Keywords
Electronics, Optoelectronics photonics, Linear and non linear optical properties, Ionization potential, Refractive index, Second order hyperpolarizability
Journal
OPTICAL AND QUANTUM ELECTRONICS
Volume 49, Issue 11, Pages -
Publisher
Springer Nature
Online
2017-11-01
DOI
10.1007/s11082-017-1221-2
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