First-Principles Studies of Adsorption of CO on the Na(100) Surface

May 10, 2000

Journal Article

First-Principles Studies of Adsorption of CO on the Na(100) Surface

Abstract

We have investigated the interaction of CO with the Na(100) substrate in the framework of density functional theory formulated for periodic systems. We established that there is an attractive but weak chemisorption bond between CO and Na(100).

Revised: September 7, 2011 | Published: May 10, 2000

Citation

Alfonso D., J.A. Snyder, J.E. Jaffe, A.C. Hess, and M.S. Gutowski. 2000. First-Principles Studies of Adsorption of CO on the Na(100) Surface. Surface Science 453, no. 1-3:130-136. PNNL-SA-31494.