Quantum chemical analysis and molecular dynamics simulations to study the impact of electron-deficient substituents on electronic behavior of small molecule acceptors
Asif Mahmood, Ahmad Irfan, Farooq Ahmad, Muhammad Ramzan Saeed Ashraf Janjua
Topics & Concepts
ChemistryMoleculeIntermolecular forceChemical physicsDipoleExcitonElectron localization functionElectronComputational chemistryOrganic chemistryPhysicsQuantum mechanicsOrganic Electronics and PhotovoltaicsPerovskite Materials and ApplicationsConducting polymers and applications