Journal
JOURNAL OF CHEMICAL PHYSICS
Volume 128, Issue 21, Pages -Publisher
AMER INST PHYSICS
DOI: 10.1063/1.2918365
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We study the simulation of charged systems in the presence of general boundary conditions in a local Monte Carlo algorithm based on a constrained electric field. We first show how to implement constant-potential, Dirichlet boundary conditions by introducing extra Monte Carlo moves to the algorithm. Second, we show the interest of the algorithm for studying systems which require anisotropic electrostatic boundary conditions for simulating planar geometries such as membranes. (c) 2008 American Institute of Physics.
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