Hartree-Fock and DFT studies of the optoelectronic, thermodynamic, structural and nonlinear optical properties of photochromic polymers containing styrylquinoline fragments
P. Noudem, D. Fouejio, C. D. D. Mveme, S. S. Zekeng, Fridolin Tchangnwa Nya, Geh Wilson Ejuh
Topics & Concepts
Density functional theoryBand gapIonization energyMaterials scienceElectronic structureBasis setSemiconductorNonlinear opticsMonomerNonlinear systemComputational chemistryPolymerChemistryIonizationOptoelectronicsPhysicsOrganic chemistryQuantum mechanicsComposite materialIonNonlinear Optical Materials ResearchNonlinear Optical Materials StudiesPhotochromic and Fluorescence Chemistry