Journal of Chemical Physics, Vol.101, No.11, 10134-10139, 1994
Bonding Geometry and Mechanism of No Adsorbed on Cu2O(111) - No Activation by Cu(+) Cations
Keywords:SELF-CONSISTENT-FIELD;CHEMISORPTION CLUSTER MODEL;CORE-LEVEL SHIFTS;CONFIGURATION-INTERACTION;IONIC-CRYSTALS;CU(100);OXYGEN;METAL;PSEUDOPOTENTIALS;POLARIZATION