A stochastic MCMC sampling method with umbrella sampling provides unbiased loop corrections to belief propagation for exact factorization-based tensor network contraction on loopy graphs with symmetric potentials.
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Alchemical insertion of water into KCl solutions produces path-dependent chemical potentials unless short-range van der Waals repulsion is activated before electrostatic interactions.
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Stochastic Loop Corrections to Belief Propagation for Tensor Network Contraction
A stochastic MCMC sampling method with umbrella sampling provides unbiased loop corrections to belief propagation for exact factorization-based tensor network contraction on loopy graphs with symmetric potentials.
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Path Dependence in Alchemical Calculations of Water Chemical Potential in Aqueous Electrolytes
Alchemical insertion of water into KCl solutions produces path-dependent chemical potentials unless short-range van der Waals repulsion is activated before electrostatic interactions.