most citedSurface molecular dynamics simulation with two orthogonal surface steps: how to beat the particle conservation problem

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cond-mat.mtrl-sci2000★ 1 cited

Surface molecular dynamics simulation with two orthogonal surface steps: how to beat the particle conservation problem

D. Passerone, U. Tartaglino, F. Ercolessi +1

Due to particle conservation, Canonical Molecular Dynamics (MD) simulations fail in the description of surface phase transitions involving coverage or lateral density changes. Howe…