The Static–Dynamic–Static Family of Methods for Strongly Correlated Electrons: Methodology and Benchmarking
Yangyang Song, Yang Guo, Yibo Lei, Ning Zhang, Wenjian Liu
Topics & Concepts
Wave functionConfiguration interactionElectronHamiltonian (control theory)Atomic orbitalFull configuration interactionPerturbation theory (quantum mechanics)Degeneracy (biology)ChemistryElectronic correlationQuantum mechanicsPhysicsMathematicsBioinformaticsExcited stateMathematical optimizationBiologyAdvanced Chemical Physics StudiesSpectroscopy and Quantum Chemical StudiesElectron Spin Resonance Studies