Casalegno, Mose, Mella, Massimo and Rappe, Andrew M. 2003. Computing accurate forces in quantum Monte Carlo using Pulay's corrections and energy minimization. The Journal of Chemical Physics 118 (16) , pp. 7193-7201. 10.1063/1.1562605 |
Item Type: | Article |
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Date Type: | Publication |
Status: | Published |
Schools: | Chemistry |
ISSN: | 00219606 |
Last Modified: | 19 Mar 2016 22:03 |
URI: | https://orca.cardiff.ac.uk/id/eprint/1458 |
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