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Solvent Dependent Nuclear Magnetic Resonance Molecular Parameters Based on a Polarization Consistent Screened Range Separated Hybrid Density Functional Theory Framework.

Authors :
Begam, Khadiza
Cohen, Lilian
Goobes, Gil
Dunietz, Barry D.
Source :
Journal of Chemical Theory & Computation; 9/13/2022, Vol. 18 Issue 9, p5259-5266, 8p
Publication Year :
2022

Details

Language :
English
ISSN :
15499618
Volume :
18
Issue :
9
Database :
Supplemental Index
Journal :
Journal of Chemical Theory & Computation
Publication Type :
Academic Journal
Accession number :
159105093
Full Text :
https://doi.org/10.1021/acs.jctc.2c00275