On the Unexpected Accuracy of the M06L Functional in the Calculation of 1JFC Spin–Spin Coupling Constants
de Giovanetti, Marinella, Bitencourt, Luis Felipe Ferraz, Cormanich, Rodrigo, Sauer, Stephan P A
Published in Journal of chemical theory and computation (14.12.2021)
Published in Journal of chemical theory and computation (14.12.2021)
Get full text
Journal Article
On the Unexpected Accuracy of the M06L Functional in the Calculation of 1 J FC Spin–Spin Coupling Constants
Giovanetti, Marinella de, Bitencourt, Luis Felipe Ferraz, Cormanich, Rodrigo, Sauer, Stephan P. A
Published in Journal of chemical theory and computation (14.12.2021)
Published in Journal of chemical theory and computation (14.12.2021)
Get full text
Journal Article