Physics-inspired machine learning of localized intensive properties

por Chen, Ke, Kunkel, Christian, Cheng, Bingqing, Reuter, Karsten, Margraf, Johannes T.
Publicado 2023

Active discovery of organic semiconductors

por Kunkel, Christian, Margraf, Johannes T., Chen, Ke, Oberhofer, Harald, Reuter, Karsten
Publicado 2021

Atomic structures and orbital energies of 61,489 crystal-forming organic molecules

por Stuke, Annika, Kunkel, Christian, Golze, Dorothea, Todorović, Milica, Margraf, Johannes T., Reuter, Karsten, Rinke, Patrick, Oberhofer, Harald
Publicado 2020