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Pseudohamiltonians and Quantum Monte Carlo
Published online by Cambridge University Press: 01 January 1992
Abstract
A new method is presented for the generation of valence-only local hamiltonians, or pseudohamiltonians, within the DFT-LDA framework. At the moment these promise to be very useful tools to overcome the problem of eliminating the core electrons from many QMC calculations.
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- Copyright © Materials Research Society 1993
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