Neil Qiang Su and Xin Xu*, Beyond energies: geometry predictions with the XYG3 type of doubly hybrid density functionals. Chem. Commun. 2016, 52, 13840-13860.
2021-03-04
Neil Qiang Su and Xin Xu*, Beyond energies: geometry predictions with the XYG3 type of doubly hybrid density functionals. Chem. Commun. 2016, 52, 13840-13860.