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The Journal of Physical Chemistry. A|March 3, 2006
Valence- and dipole-bound anions of the thymine-water complex: ab initio characterization of the potential energy surfacesTomaso Frigato, Daniel Svozil, Pavel JungwirthPhysical Chemistry Chemical Physics : PCCP|October 2, 2009
Ab initio electronic structure of thymine anionsDaniel Svozil, Tomaso Frigato, Zdenek Havlas, et al.Physical Review Letters|September 28, 2010
Dynamics of electron localization in warm versus cold water clustersOndrej Marsalek, Frank Uhlig, Tomaso Frigato, et al.Journal of Molecular Biology|October 8, 2003
The mechanism of proton exclusion in the aquaporin-1 water channelBert L de Groot, Tomaso Frigato, Volkhard Helms, et al.The Journal of Physical Chemistry. A|June 13, 2008
Ab initio molecular dynamics simulation of a medium-sized water cluster anion: from an interior to a surface-located excess electron via a delocalized stateTomaso Frigato, Joost VandeVondele, Burkhard Schmidt, et al.Journal of Computational Chemistry|July 19, 2006
Energy barriers of proton transfer reactions between amino acid side chain analogs and water from ab initio calculationsElena Herzog, Tomaso Frigato, Volkhard Helms, et al.The Journal of Physical Chemistry. B|September 24, 2010
Atomistic simulation of water percolation and proton hopping in Nafion fuel cell membraneRam Devanathan, Arun Venkatnathan, Roger Rousseau, et al.The Journal of Physical Chemistry. B|December 8, 2009
Hydrogen forms in water by proton transfer to a distorted electronOndrej Marsalek, Tomaso Frigato, Joost VandeVondele, et al.The Journal of Physical Chemistry. B|July 21, 2006
Unified molecular picture of the surfaces of aqueous acid, base, and salt solutionsMartin Mucha, Tomaso Frigato, Lori M Levering, et al.Pageof 1