E J Baerends

Can the Counterpoise Correction for Basis Set Superposition Effect Be Justified?

Ł M Mentel, E J Baerends, E. Baerends, 2014, Journal of chemical theory and computation.

Exact exchange-correlation treatment of dissociated H(2) in density functional theory.

E J Baerends, E. Baerends, 2001, Physical review letters.

Adsorption and diffusion on a stepped surface: atomic hydrogen on Pt(211).

E J Baerends, E. Baerends, R. A. Olsen, 2004, The Journal of chemical physics.

Charge transfer, double and bond-breaking excitations with time-dependent density matrix functional theory.

E J Baerends, E. Baerends, O. Gritsenko, 2008, Physical review letters.

A new model for the agonistic binding site on the histamine H2-receptor: the catalytic triad in serine proteases as a model for the binding site of histamine H2-receptor agonists.

E J Baerends, E. Baerends, H. Timmerman, 1994, Journal of molecular graphics.

Response calculations with an independent particle system with an exact one-particle density matrix.

E J Baerends, E. Baerends, O. Gritsenko, 2010, Physical review letters.

The Kohn-Sham gap, the fundamental gap and the optical gap: the physical meaning of occupied and virtual Kohn-Sham orbital energies.

E J Baerends, E. Baerends, O. Gritsenko, 2013, Physical chemistry chemical physics : PCCP.