Now showing items 1-1 of 1

    • Chamorro, Eduardo; López, Patricia; De Proft, Frank; Geerlings, P. (AMER INST PHYSICS, 2006-01-28)
      The electrophilicity index is analyzed within the framework of spin-polarized density-functional theory. In this context, constrained philicities, omega(N)equivalent to(mu(N))(2)/(2 eta(NN)), are introduced in order to ...