Robin J Shannon

5PUBLICATIONS
12CO-AUTHORS
Process control and simulationChemical thermodynamics and energeticsStatistical mechanics in chemistryReaction kinetics and dynamicsChemical and thermal processes in energy and combustion
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Publications (5)

|Jul 20, 2021
ChemDyME: Kinetically Steered, Automated Mechanism Generation through Combined Molecular Dynamics and Master Equation Calculations.

Robin J Shannon, Emilio Martínez-Núñez, Dmitrii V Shalashilin

|Apr 21, 2021
Nonadiabatic Kinetics in the Intermediate Coupling Regime: Comparing Molecular Dynamics to an Energy-Grained Master Equation.

Darya Shchepanovska, Robin J Shannon, Basile F E Curchod

|Feb 23, 2019
Anharmonic Molecular Mechanics: Ab Initio Based Morse Parametrizations for the Popular MM3 Force Field.

R J Shannon, B Hornung, D P Tew

|Jul 26, 2018
Adaptively Accelerating Reactive Molecular Dynamics Using Boxed Molecular Dynamics in Energy Space.

Robin J Shannon, Silvia Amabilino, Mike O'Connor

|Mar 02, 2018
Comment on "Methanol dimer formation drastically enhances hydrogen abstraction from methanol by OH at low temperature" by W. Siebrand, Z. Smedarchina, E. Martínez-Núñez and A. Fernández-Ramos, Phys. Chem. Chem. Phys., 2016, 18, 22712.

R J Shannon, J C Gómez Martín, R L Caravan

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Frequent Collaborators

3 joint publications

David R Glowacki

2 joint publications

Dmitrii V Shalishilin

1 joint publications

J C Gómez Martín

1 joint publications

R L Caravan