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Multiscale Sampling of a Heterogeneous Water/Metal Catalyst Interface using Density Functional Theory and Force-Field Molecular Dynamics
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Many-body partition function and thermal hartree-fock approximations

Farid1, March, Theophilou

  • 1Max Planck Institute fur Festkorperforschung, Heisenbergstrasse 1, 70569 Stuttgart, Germany.

Physical Review. E, Statistical Physics, Plasmas, Fluids, and Related Interdisciplinary Topics
|November 23, 2000
PubMed

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