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Ab initio NMR parameters of BrCH3 and ICH3 with relativistic and vibrational corrections
Ab initio NMR parameters of BrCH3 and ICH3 with relativistic and vibrational corrections
2018
Tereza Uhlíková
Štěpán Urban
Keywords:
Computational chemistry
Ab initio
Chemistry
Physical chemistry
nmr shielding
Correction
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