Christopher J Mundy

6PUBLICATIONS
27CO-AUTHORS
Chemical thermodynamics and energeticsComputational chemistryReaction kinetics and dynamicsTransport properties and non-equilibrium processesMolecular imaging (incl. electron microscopy and neutron diffraction)
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Publications (6)

|Dec 02, 2021
Probing the thermodynamics and kinetics of ethylene carbonate reduction at the electrode-electrolyte interface with molecular simulations.

Luke D Gibson, Jim Pfaendtner, Christopher J Mundy

|Mar 09, 2021
CP2K: An electronic structure and molecular dynamics software package - Quickstep: Efficient and accurate electronic structure calculations.

Thomas D Kühne, Marcella Iannuzzi, Mauro Del Ben

|Jul 17, 2020
Solvent reaction coordinate for an SN2 reaction.

Christian Leitold, Christopher J Mundy, Marcel D Baer

|Nov 24, 2018
Detecting the undetectable: The role of trace surfactant in the Jones-Ray effect.

Timothy T Duignan, Mengsu Peng, Anh V Nguyen

|Oct 04, 2018
Unraveling the spectral signatures of solvent ordering in K-edge XANES of aqueous Na.

M Galib, G K Schenter, C J Mundy

|Jun 17, 2018
Understanding the scale of the single ion free energy: A critical test of the tetra-phenyl arsonium and tetra-phenyl borate assumption.

Timothy T Duignan, Marcel D Baer, Christopher J Mundy

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Frequent Collaborators

3 joint publications

Gregory K Schenter

2 joint publications

Timothy T Duignan

1 joint publications

N Govind

1 joint publications

Anh V Nguyen