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Materials Design On-the-Fly

Tiago F. T. Cerqueira 1 Rafael Sarmiento-Perez Maximilian Amsler F. Nogueira Silvana Botti 1 Miguel Alexandre Lopes Marques 1 
1 ILM - Institut Lumière Matière [Villeurbanne]
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https://hal-univ-lyon1.archives-ouvertes.fr/hal-02308156
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Submitted on : Tuesday, October 8, 2019 - 12:56:33 PM
Last modification on : Thursday, October 15, 2020 - 8:54:03 AM

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Tiago F. T. Cerqueira, Rafael Sarmiento-Perez, Maximilian Amsler, F. Nogueira, Silvana Botti, et al.. Materials Design On-the-Fly. Journal of Chemical Theory and Computation, American Chemical Society, 2015, 11, pp.3955-3960. ⟨10.1021/acs.jctc.5b00212⟩. ⟨hal-02308156⟩

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