Browsing by Subject "Electronic population analysis"

Now showing items 1-1 of 1

    • An information-theoretic resolution of the ambiguity in the local hardness 
      Heidar Zadeh, Farnaz; Fuentealba Rosas, Patricio; Cardenas Valencia, Carlos; Ayers, Paul W. (Royal Society of Chemistry, 2014)
      The ambiguity of the local hardness is resolved by using information theory to select definitions of the local hardness that are as close as possible to a well-defined approximate formula for the local hardness. A condensed ...