Theoretical study of the mechanism of the solvent dependency of ESIPT in HBT
Keiji Naka, Hirofumi Sato, Masahiro Higashi
Abstract
DFT and TDDFT calculations demonstrated that the photochemical process in HBT is determined by how the HBT forms intermolecular hydrogen bonds with solvent molecules.
Topics & Concepts
Heterojunction bipolar transistorSolventIntermolecular forceTime-dependent density functional theoryPhotochemistryHydrogen bondMoleculeChemistryComputational chemistryDependency (UML)Chemical physicsDensity functional theoryOrganic chemistryComputer sciencePhysicsSoftware engineeringBipolar junction transistorVoltageQuantum mechanicsTransistorLuminescence and Fluorescent MaterialsAtmospheric Ozone and ClimatePhotochemistry and Electron Transfer Studies