Adjanor, G.; Athènes, M.; Calvo, F. - In: The European Physical Journal B - Condensed Matter and … 53 (2006) 1, pp. 47-60
We introduce a path-sampling scheme that allows equilibrium state-ensemble averages to be computed by means of a biased distribution of non-equilibrium paths. This non-equilibrium method is applied to the case of the 38-atom Lennard-Jones atomic cluster, which has a double-funnel energy...