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Julius B. Kleine Büning

  1. Computation of CCSD(T)-Quality NMR Chemical Shifts via Δ-Machine Learning from DFT
    2023/06/01 by Julius B. Kleine Büning, Stefan Grimme · 1 voice · 1 citation
    Biochemistry, Genetics and Molecular Biology · Chemistry · #Advanced NMR Techniques and Applications #Metabolomics and Mass Spectrometry Studies #Molecular spectroscopy and chirality