The Journal of Chemical Physics · 1989 · 1.2K citations · 26 references
Natural SciencesPhysicsComputational ChemistryComputational PhysicsScientific ComputingAb Initio MethodsComputational Quantum ChemistryConfiguration InteractionCoupled Cluster TheoryStrong InteractionStrongly Correlated Electron SystemsConfiguration Interaction DoublesCoupled Cluster DoublesCoupled Cluster SinglesCoupled-cluster CalculationsQuadratic Configuration InteractionSubstitutions
It is shown that the recently proposed QCI method including all single and double substitutions has essentially the same computational requirements as the more complete CCSD approach. If properly formulated, the CCSD equations contain at most quadratic terms in the excitation amplitudes.
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