Natural-abundance 13C zero-field NMR spectra are measured on liquids with a commercial 87Rb magnetometer and predicted by vibrationally-corrected DFT with few-hertz accuracy.
Pavoˇ sevi´ c, F
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DFT-assisted natural abundance 13C zero-field NMR via optical magnetometry
Natural-abundance 13C zero-field NMR spectra are measured on liquids with a commercial 87Rb magnetometer and predicted by vibrationally-corrected DFT with few-hertz accuracy.