Changchun
China
Northeast Normal University
Proton-migration, Aromaticity, First hyperpolarizability, DFT, TD-DFT, Spectroscopy
Ionic liquids, Density functional theory, Thermodynamics, Hirshfeld Surface, AIM
Ionic liquids, Hirshfeld analysis, AIM, Anti-Cancer, ADME, Molecular Docking, MD simulation
corannulene dimer, the external electric field, the molecular electrostatic potential, the first hyperpolarizability, NLO materials
corannulene dimer, the external electric field, the molecular electrostatic potential, the first hyperpolarizability
Ionic liquids, Density Functional Theory, Thermodynamics, Hirshfeld Surface, AIM
the wing-shaped nanographene, the external electric field, the molecular electrostatic potential maps, the first hyperpolarizabilities
Visulization, Molecular Hinge, Acid/Base-Responsive, Multi-Information Storage, Advanced Encryption