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Journal Article (3)
1.
Journal Article
123 (40), pp. 8457 - 8471 (2019)
Surface of half-neutralized diamine triflate ionic liquids. A molecular dynamics study of structure, thermodynamics, and kinetics of water absorption and evaporation. The Journal of Physical Chemistry B 2.
Journal Article
52 (14), pp. 5307 - 5316 (2019)
Backbone Chemical Composition and Monomer Sequence Effects on Phenylene Polymer Persistence Lengths. Macromolecules 3.
Journal Article
120 (9), pp. 5083 - 5100 (2016)
First-Principles Study of the Structural, Electronic, Dynamic, and Mechanical Properties of HOPG and Diamond: Influence of Exchange-Correlation Functionals and Dispersion Interactions. The Journal of Physical Chemistry C