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Hartree-Fock Density-Matrix Renormalization Group for Very Long Chains

White, Steven R.
arXiv (OAI Expanded) · Papers
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atomic-physicschemical-physicscomputational-physicsstrongly-correlated-electrons
We formulate Hartree--Fock as a density-matrix renormalization group (DMRG) sweep of a single Slater determinant, assuming a density--density electron--electron interaction. We compress the occupied state and long-range interaction separately, reducing each sweep step to a small local Fock problem.
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