[RMCProfile-users] half-box or periodic boundary conditions
Karl Pazdernik
ktpazder at ncsu.edu
Tue Apr 19 21:58:27 BST 2016
Hello experts,
I have a quick question: how does RMCProfile handle the edge atoms? Does
it perform calculations based on reduced set of central atoms from the full
supercell or does it use periodic boundary conditions?
--
Karl Pazdernik, Ph.D.
Department of Statistics
North Carolina State University
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