Parents

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H. Ted Davis grad student 1996 UMN (Chemistry Tree)
Alon V. McCormick grad student 1996 UMN (Chemistry Tree)
 (Molecular models of adsorption and diffusion in nanoporous materials)

Collaborators

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Jun Mo Kim collaborator 2005-2010 University of Tennessee (CSD Tree)
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Publications

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Cladek BR, Everett SM, McDonnell MT, et al. (2021) Local structure and distortions of mixed methane-carbon dioxide hydrates. Communications Chemistry. 4: 6
Nicholson DM, Gao CY, McDonnell MT, et al. (2021) Entropy Pair Functional Theory: Direct Entropy Evaluation Spanning Phase Transitions. Entropy (Basel, Switzerland). 23
Cladek BR, Everett SM, McDonnell MT, et al. (2019) Molecular Rotational Dynamics in Mixed CH4–CO2 Hydrates: Insights from Molecular Dynamics Simulations The Journal of Physical Chemistry C. 123: 26251-26262
McDonnell MT, Keffer DJ. (2018) Reactive molecular dynamics simulations of an excess proton in polyethylene glycol-water solutions Molecular Simulation. 45: 381-393
Cladek BR, Everett SM, McDonnell MT, et al. (2018) Guest–Host Interactions in Mixed CH4–CO2 Hydrates: Insights from Molecular Dynamics Simulations The Journal of Physical Chemistry C. 122: 19575-19583
McNutt NW, McDonnell MT, Rios O, et al. (2017) Li-ion Localization and Energetics as a Function of Anode Structure. Acs Applied Materials & Interfaces
McDonnell MT, Greeley DA, Kit KM, et al. (2016) Molecular Dynamics Simulations of Hydration Effects on Solvation, Diffusivity, and Permeability in Chitosan/Chitin Films. The Journal of Physical Chemistry. B
McDonnell MT, Xu H, Keffer DJ. (2016) Ab Initio Molecular Dynamics Simulations of an Excess Proton in a Triethylene Glycol-Water Solution: Solvation Structure, Mechanism and Kinetics. The Journal of Physical Chemistry. B
Deng S, Hassan MK, Nalawade A, et al. (2015) High temperature proton exchange membranes with enhanced proton conductivities at low humidity and high temperature based on polymer blends and block copolymers of poly(1,3-cyclohexadiene) and poly(ethylene glycol) Polymer (United Kingdom). 77: 208-217
McDonnell MT, Keffer DJ. (2013) Intrinsic relationships between proton conductivity and nanopore size and functionalization Microporous and Mesoporous Materials. 177: 17-24
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