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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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Anisotropic intracule densities and electron correlation in H2: a quantum Monte Carlo study

Manolo C Per1, Salvy P Russo, Ian K Snook

  • 1Applied Physics, School of Applied Sciences, RMIT University, G.P.O. Box 2476V, Melbourne, Victoria 3001, Australia. manolo.per@rmit.edu.au

The Journal of Chemical Physics
|April 10, 2009
PubMed

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