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TY - CONF AU - Harper, Angela F. AU - Civaia, Federico AU - Valenzuela Reina, Javier AU - Köcher, Simone Swantje AU - Reuter, Karsten AU - Scheurer, Christoph TI - Advanced NMR parameter simulations: combining first principles and machine learning M1 - FZJ-2024-00187 PY - 2023 T2 - FHI Poster Week CY - 14 Nov 2023 - 14 Nov 2023, Berlin (Germany) Y2 - 14 Nov 2023 - 14 Nov 2023 M2 - Berlin, Germany LB - PUB:(DE-HGF)24 UR - https://juser.fz-juelich.de/record/1020468 ER -