Investigating rare events by transition interface sampling

Daniele Moroni, Titus S. van Erp and Peter G. Bolhuis

Physica A: Statistical Mechanics and its Applications, 2004, vol. 340, issue 1, 395-401

Abstract: We briefly review simulation schemes for the investigation of rare transitions and resume the recently introduced transition interface sampling, a method in which the computation of rate constants is recast into the computation of fluxes through interfaces dividing the reactant and product state.

Keywords: Rare events; Rate constants; Transition path sampling (search for similar items in EconPapers)
Date: 2004
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Citations: View citations in EconPapers (1)

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Persistent link: https://EconPapers.repec.org/RePEc:eee:phsmap:v:340:y:2004:i:1:p:395-401

DOI: 10.1016/j.physa.2004.04.033

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