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Controlling the accuracy of the density-matrix renormalization-group method: The dynamical block state selection approach

Controlling the accuracy of the density-matrix renormalization-group method: The dynamical block state selection approach

We have applied the momentum space version of the Density Matrix Renormalization Group method ($k$-DMRG) in quantum chemistry in order to study the accuracy of the algorithm in the new context. We have shown numerically that it is possible to determine the desired accuracy of the method in advance of …