Time-Sliced Thawed Gaussian Propagation Method for Simulations of Quantum Dynamics
Kong X, Markmann A, Batista V. Time-Sliced Thawed Gaussian Propagation Method for Simulations of Quantum Dynamics. The Journal Of Physical Chemistry A 2016, 120: 3260-3269. PMID: 26845486, DOI: 10.1021/acs.jpca.5b12192.Peer-Reviewed Original ResearchQuantum dynamicsFourth-order Runge-KuttaTime-evolved stateHusimi transformRunge-KuttaCharacteristic equationInitial superpositionGaussian methodOverlap matrixLinear superpositionVelocity VerletIntegral calculationQuantum tunnelingTransform methodFourier transform methodBenchmark calculationsQuantitative agreementPropagation methodRigorous methodGaussianDynamic propagationSimulationsSuperpositionDynamicsEquations