Vibrational Spectroscopy in Solution through Perturbative ab Initio Molecular Dynamics Simulations - Université de Lorraine Access content directly
Journal Articles Journal of Chemical Theory and Computation Year : 2019
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hal-02267772 , version 1 (19-08-2019)

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Carlos Bistafa, Yukichi Kitamura, Marilia Martins-Costa, Masataka Nagaoka, Manuel Ruiz-Lopez. Vibrational Spectroscopy in Solution through Perturbative ab Initio Molecular Dynamics Simulations. Journal of Chemical Theory and Computation, 2019, 15 (8), pp.4615-4622. ⟨10.1021/acs.jctc.9b00362⟩. ⟨hal-02267772⟩
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