title: Three-dimensional Ewald method with correction term for a system periodic in one direction.
abstract: A three-dimensional Ewald summation formula with a shape-dependent correction term for Coulomb interactions in systems with one-dimensional periodicity is derived. Test molecular dynamics simulations of acetone molecules in cylindrical silica pores show that the formula is efficient only when size of the system in a plane perpendicular to the periodicity direction is small in comparison with the periodicity length.
authors.affiliation: Institute of Physics, University of Silesia, Uniwersytecka 4, 40-007 Katowice, Poland.
authors.forename: A
authors.initials: A
authors.lastname: Bródka
authors.forename: P
authors.initials: P
authors.lastname: Sliwiński