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October 2012

Uppsala: Efficient and Reliable Simulation of Quantum Molecular Dynamics (disertation)

19 October, 2012 @ 10:00 - 12:00
ITC room 2446, Polacksbacken, Lägerhyddsvägen 2D
Uppsala, Sweden
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Dissertation presented Uppsala University to be publicly examined in 2446, Polacksbacken, Lägerhyddsvägen 2, Uppsala, Friday, October 19, 2012 at 10:00 for degree of Doctor of Philosophy. The examination will be conducted in English. Abstract: Kormann, K, 2012, Digital Comprehensive Summaries of Uppsala Dissertations from the Faculty of Science and Technology 970, 52 pp. Uppsla, ISBN 978-91-554-8466-8. The time-dependent Schrödinger equation (TDSE) models the quantum nature of molecular processes.  Numerical simulations based on the TDSE help in understanding and predicting the…

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