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On the Unexpected Accuracy of the M06L Functional in the Calculation of 1JFC Spin–Spin Coupling Constants.
- Source :
- Journal of Chemical Theory & Computation; 12/14/2021, Vol. 17 Issue 12, p7712-7723, 12p
- Publication Year :
- 2021
Details
- Language :
- English
- ISSN :
- 15499618
- Volume :
- 17
- Issue :
- 12
- Database :
- Supplemental Index
- Journal :
- Journal of Chemical Theory & Computation
- Publication Type :
- Academic Journal
- Accession number :
- 154245734
- Full Text :
- https://doi.org/10.1021/acs.jctc.1c00287