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Can TDDFT render the electronic excited states ordering of Azine derivative? A closer investigation with DLPNO-STEOM-CCSD

Kalishankar Bhattacharyya

2021Chemical Physics Letters46 citationsDOI

Topics & Concepts

AzineTime-dependent density functional theoryDerivative (finance)Excited stateDensity functional theoryChemistryComputational chemistryPhysicsAtomic physicsOrganic chemistryEconomicsFinancial economicsOrganic Light-Emitting Diodes ResearchLuminescence and Fluorescent MaterialsOrganic Electronics and Photovoltaics
Can TDDFT render the electronic excited states ordering of Azine derivative? A closer investigation with DLPNO-STEOM-CCSD | Litcius