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The bonding of CO to a platinum surface: relativistic cluster studies

✍ Scribed by Cary Y. Yang; Hsi-Ling Yu; David A. Case

Publisher
Elsevier Science
Year
1981
Tongue
English
Weight
410 KB
Volume
81
Category
Article
ISSN
0009-2614

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✦ Synopsis

Dirac -Slarer multiple scattering calculations are presented for CO bound to small platinum clusters. Crystal field models and non-reIativistic 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. Volume 8 1, number 1 CHEMICAL PHYSICS LETl-ERS Cl d Oh CC,", C3") Cl d 2312 =JZ d *3/z 312 d *'J2 312

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