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Posters of recent research (click on picture to enlarge)
Thermodynamic properties of clusters: Quantum versus Classical Mechanics Quantum Decoherence Using Classical Trajectory Ensembles: Simulating Experimental Vibrational Dephasing of I2 in Solid Kr Development of DFT/TDDFT Conformational Analysis, Reaction Mechanisms, and Structure Elucidation Isotope Effects Isotope Effects Molecular dynamics simulations and electronic structure calculations applied to atmospheric and biophysical chemistry