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      • Jiří Pittner

      2 results in Jiří Pittner in Authors: Jiří Pittner

      Category: Theoretical and Computational Chemistry
      ,
      Working Paper
      , Title:

      The Newton-X platform: new software developments for surface hopping and nuclear ensembles

      , Authors: Mario BARBATTI, Mattia Bondanza, Rachel Crespo-Otero, Baptiste Demoulin, Pavlo Dral, Giovanni Granucci, Fabris Kossoski, Hans Lischka, Benedetta Mennucci, Saikat Mukherjee, Marek Pederzoli, Maurizio Persico, Max Pinheiro Jr, Jiri Pittner, Felix Plasser, Eduarda Sangiogo Gil, Lijljana Stojanovic
      Version 1 posted 11 August 2022
      493
      Downloads
      Category: Theoretical and Computational Chemistry
      ,
      Working Paper
      , Title:

      A Descriptor Is All You Need: Accurate Machine Learning of Nonadiabatic Coupling Vectors

      , Authors: Jakub Martinka, Lina Zhang, Yi-Fan Hou, Mikołaj Martyka, Jiří Pittner, Mario Barbatti, Pavlo O. Dral
      Version 1 posted 29 May 2025
      31
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