Combined Pseudopotential and Density Functional Study of Bis-6-benzene d and f Element Complexes. - Michael Dolg (J. Chem. Inf. Comput. Sci., 2001)

Relativistic energy-consistent pseudopotentials - Recent developments. - Hermann Stoll; Bernhard Metz; Michael Dolg (J. Comput. Chem., 2002)

A theoretical study of imine hydrocyanation catalyzed by halogen-bonding. - Norah Heinz; Michael Dolg; Albrecht Berkessel (J. Comput. Chem., 2015)

Quantum chemical study of the autoxidation of ascorbate. - Nils Herrmann; Norah Heinz; Michael Dolg; Xiaoyan Cao (J. Comput. Chem., 2016)

Density Functional Studies of Coenzyme NADPH and Its Oxidized Form NADP+: Structures, UV-Vis Spectra, and the Oxidation Mechanism of NADPH. - Xiaoyan Cao; Liangliang Wu; Jun Zhang; Michael Dolg (J. Comput. Chem., 2020)

Periodic trends and complexation chemistry of tetravalent actinide ions with a potential actinide decorporation agent 5-LIO(Me-3, 2-HOPO): A relativistic density functional theory exploration. - Biswajit Sadhu; Michael Dolg; Mukund S. Kulkarni (J. Comput. Chem., 2020)