Doping of some corannulenes of general formula C5n2H5n (n = 2,3,4) with boron–nitride (B–N) units at the rim position: applications in electronics, optoelectronics and nonlinear optics devices

The electronic, optoelectronic, linear and nonlinear optical (NLO) properties of some corannulenes of formula C 5n 2 H 5n (with n  = [2,4]), doped with boron–nitride units at the rim position, have been studied using density functional theory (DFT) and time-dependent DFT (TD-DFT) calculations. This...

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