Browsing Kjemisk institutt by Author "Ravera, Enrico"

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  • Theoretical analysis of the long-distance limit of NMR chemical shieldings 
    Lang, Lucas; Ravera, Enrico; Parigi, Giacomo; Luchinat, Claudio; Neese, Frank (Journal article / Tidsskriftartikkel / PublishedVersion; Peer reviewed, 2022)
    After some years of controversy, it was recently demonstrated how to obtain the correct long-distance limit [point-dipole approximation (PDA)] of pseudo-contact nuclear magnetic resonance chemical shifts from rigorous ...