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Jean-Marc Leyssale

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Reaction kinetics and dynamics

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Publications (1)

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|Jan 17, 2020

Timescale prediction of complex multi-barrier pathways using flux sampling molecular dynamics and 1D kinetic integration: Application to cellulose dehydration.

Pierre-Louis Valdenaire, Roland J M Pellenq, Franz J Ulm

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Adri C T van Duin

Frequent Collaborators

1 joint publications

Adri C T van Duin

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