The Journal of Chemical Physics · 1993 · 335 citations · 25 references
Natural SciencesPhysicsComputational PhysicsMolecular PhysicsQuantum MechanicsComputational Quantum MechanicsLaser OpticsNumerical Methods For Differential EquationsQuantum DynamicsSchrödinger EquationUltrafast OpticsCoherent ExcitationCoupled Schrödinger EquationsNumerical Solution Of The Schrödinger EquationNumerical Solutions Of Partial Differential EquationsOperator SplittingQuantum Propagator
Coherent excitation of molecules with laser pulses are usually described by coupled time-dependent linear parabolic partial differential equations, i.e., Schrödinger equations. Numerical solutions of these equations based on splitting (factorization) of the exponential form of the evolution operator or time-dependent propagator are examined for accuracy of amplitude and phase as a function of various unitary splitting schemes.
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Construction of higher order symplectic integrators
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Elementary Numerical Analysis.
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