Tom K. Woo, Ph.D.

Affiliations: 
2005- Chemistry University of Ottawa, Ottawa, ON, Canada 
Area:
computational chemistry, metal organic frameworks, molecular dynamics, chemoinformatics, quantum chemistry, ab initio molecular dynamics, QM/MM
Website:
http://titan.chem.uottawa.ca
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"Tom Woo"
Bio:

Tom earned a Ph.D in Chemistry from the University of Calgary under the supervision of famed theoretical chemist Tom Ziegler in 1998. His Ph.D. thesis won the Canadian Association of Graduate Studies Distinguished Dissertation Award for Natural Sciences, Health Sciences and Engineering (only 1 awarded per year). He was then awarded a prestigious NSERC Post-doctoral fellowship where he worked at the ETH Zürich, Switzerland, with Prof. Röthlisberger and van Gunsteren 1998-1999. Following that Tom became an Assistant Professor at the University of Western Ontario in London, Ontario from 2000-2005 where he was awarded the Premier’s Research Excellence (early career) Award and various undergraduate Teaching honours. In late 2005, moved to the University of Ottawa as a Canada Research Chair in Catalyst Modelling and Computational Chemistry where he is currently a Full Professor of Chemistry. Tom

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Publications

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Naeiji P, Woo TK, Alavi S, et al. (2019) Molecular Dynamic Simulations of Clathrate Hydrate Anomalous Preservation: The Effect of Coating Clathrate Hydrate Phases The Journal of Physical Chemistry C. 123: 28715-28725
Krykunov M, Woo TK. (2018) Bond type restricted property weighted radial distribution functions for accurate machine learning prediction of atomization energies. Journal of Chemical Theory and Computation
Dureckova H, Woo TK, Udachin KA, et al. (2017) The anomalous halogen bonding interactions between chlorine and bromine with water in clathrate hydrates. Faraday Discussions
Dureckova H, Woo TK, Alavi S. (2016) Molecular simulations and density functional theory calculations of bromine in clathrate hydrate phases. The Journal of Chemical Physics. 144: 044501
Monyoncho EA, Steinmann SN, Michel C, et al. (2016) Ethanol Electro-oxidation on Palladium Revisited Using Polarization Modulation Infrared Reflection Absorption Spectroscopy (PM-IRRAS) and Density Functional Theory (DFT): Why Is It Difficult To Break the C–C Bond? Acs Catalysis. 6: 4894-4906
Mullangi D, Dhavale V, Shalini S, et al. (2016) Low-Overpotential Electrocatalytic Water Splitting with Noble-Metal-Free Nanoparticles Supported in a sp3 N-Rich Flexible COF Advanced Energy Materials
Dureckova H, Woo TK, Alavi S, et al. (2015) Molecular dynamics simulation of halogen bonding in Cl2, BrCl, and mixed Cl2/Br2 clathrate hydrates Canadian Journal of Chemistry. 93: 864-873
Fernandez M, Trefiak NR, Woo TK. (2013) Atomic property weighted radial distribution functions descriptors of metal-organic frameworks for the prediction of gas uptake capacity Journal of Physical Chemistry C. 117: 14095-14105
Li J, Pandelieva AT, Rowley CN, et al. (2012) Importance of secondary interactions in twisted doubly hydrogen bonded complexes. Organic Letters. 14: 5772-5
Nohra M, Woo TK, Alavi S, et al. (2012) Molecular dynamics Gibbs free energy calculations for CO2 capture and storage in structure i clathrate hydrates in the presence of SO 2, CH4, N2, and H2S impurities Journal of Chemical Thermodynamics. 44: 5-12
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