The ICC* Algorithm: A fast way to include dielectric boundary effects into molecular dynamics simulations

Details The ICC* Algorithm: A fast way to include dielectric boundary effects into molecular dynamics simulations The ICC* Algorithm: A fast way to include dielectric boundary effects into molecular dynamics simulations

2010-03-05

arxiv.org/abs/1003.1271v1

Physics

Condensed Matter

Soft Condensed Matter

3 pages, 2 figures

Scientific paper

We employ a fast and accurate algorithm to treat dielectric interfaces within
molecular dynamics simulations and demonstrate the importance of dielectric
boundary forces (DBFs) in two systems of interests in soft-condensed matter
science. We investigate a salt solution confined to a slit pore, and a model of
a DNA fragment translocating thorugh a narrow pore.

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