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Analytical excited state forces for the time-dependent density-functional tight-binding method [Journal of Computational Chemistry 28, 2589]

D. Heringer, T. A. Niehaus, M. Wanko, Thomas Frauenheim. Analytical excited state forces for the time-dependent density-functional tight-binding method [Journal of Computational Chemistry 28, 2589]. Journal of Computational Chemistry, 33(5):593, 2012. [doi]

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