A systematic study on the fixed-node and localization error in quantum Monte Carlo calculations with pseudopotentials for group III elements
Autor: | Flad, Heinz-Jürgen, Savin, Andreas, Schultheiss, Martin, Nicklass, Andreas, Preuss, Heinzwerner |
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Zdroj: | In Chemical Physics Letters 1994 222(3):274-280 |
Databáze: | ScienceDirect |
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