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Ab initio photodynamics calculations on the Grid: approaches and applications

Ab initio photodynamics calculations on the Grid: approaches and applications. Hans Lischka, Matthias Ruckenbauer, Wilfried Gansterer and Osvaldo Gervasi University of Vienna and University of Perugia. Quantum Chemistry and Molecular Simulations.

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Surface hopping - PowerPoint PPT Presentation

Ab initio photodynamics calculations on the Grid: approaches and applications