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- W2094111365 abstract "A method is presented for the generation of valence-only local Hamiltonians, or pseudo-Hamiltonians, within the framework of the local-density-functional theory. Extensive transferability tests for atoms and crystals show that the performance of pseudo-Hamiltonians in density-functional-theory calculations matches the standards of other state-of-the-art methods. These pseudo-Hamiltonians represent a useful tool for quantum Monte Carlo simulations of many sp-bonded valence-only systems." @default.
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- W2094111365 date "1995-07-01" @default.
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- W2094111365 title "Local norm-conserving pseudo-Hamiltonians" @default.
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- W2094111365 doi "https://doi.org/10.1103/physreva.52.236" @default.
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