1. Electronic factors determining the reactivity of metal surfaces;Hammer;Surf. Sci.,1995
2. Strain and coordination effects in the adsorption properties of early transition metals: A density-functional theory study;Schnur;Phys. Rev. B,2010
3. An improved d-band model of the catalytic activity of magnetic transition metal surfaces;Bhattacharjee;Sci. Rep.,2016
4. Hirshfeld surface analysis;Spackman;Cryst. Eng. Comm.,2009
5. Energy decomposition analysis of single bonds within Kohn-Sham density functional theory;Levine;J. Chem. Phys.,2005