papers
Publications (6)
physics.atom-ph2007
A Quantum Similarity Study of Atomic Density Functions: Insights from Information Theory and the Role of Relativistic Effects
A. Borgoo, M. Godefroid, Paul Indelicato +2
physics.atom-ph2010
Energy surface, chemical potentials, Kohn-Sham energies in spin-polarized density functional theory
T. Gal, P. Geerlings
physics.chem-ph2009
On the thermodynamical analogy in spin-polarized density functional theory
T. Gal, P. W. Ayers, F. De Proft +1
physics.chem-ph2011
A new approach to local hardness
T. Gal, P. Geerlings, F. De Proft +1
physics.atom-ph2011
Atomic density functions: atomic physics calculations analyzed with methods from quantum chemistry
Alex Borgoo, Michel R. Godefroid, P. Geerlings
physics.atom-ph2009
Derivative of the Lieb definition for the energy functional of density functional theory with respect to the particle number and the spin number
T. Gal, P. Geerlings