The Bonding of CO to a Platinum Surface: Relativistic Cluster Studies
Elsevier B. V.
Dirac-Slater multiple scattering calculations are presented for CO bound to small platinum clusters. Crystal field models and non-relativistic decompositions are used to describe adsorption in the top, bridge and four-fold hole sites. For these geometries, the net charges transferred from CO are 0.19, 0.00 and −0.06 electrons, respectively.
C.Y. Yang, H.L. Yu, and D.A. Case, “The Bonding of CO to a Platinum Surface: Relativistic Cluster Studies,” Chemical Physics Letters 81, 170-174 (1981).