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Communication: Toward an improved control of the fixed-node error in quantum Monte Carlo: The case of the water

Michel Caffarel1, Thomas Applencourt1, Emmanuel Giner2

  • 1Laboratoire de Chimie et Physique Quantique, CNRS-Université de Toulouse, Toulouse, France.

The Journal of Chemical Physics
|July 9, 2016
PubMed

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