Publications en collaboration avec des chercheurs de University of Manchester (3)

2013

  1. Domain-averaged exchange-correlation energies as a physical underpinning for chemical graphs

    ChemPhysChem, Vol. 14, Núm. 6, pp. 1211-1218

2011

  1. Nature of chemical interactions from the profiles of electron delocalization indices

    Journal of Chemical Theory and Computation, Vol. 7, Núm. 6, pp. 1704-1711

2010

  1. Convergence of the multipole expansion for 1,2 Coulomb interactions: The modified multipole shifting algorithm

    Journal of Chemical Physics, Vol. 132, Núm. 19