Article ID | Journal | Published Year | Pages | File Type |
---|---|---|---|---|
5422582 | Surface Science | 2012 | 10 Pages |
Abstract
⺠Calculated binding geometries and energies of small adsorbates on Pd(111). ⺠Calculated vibrational frequencies of adsorbates on Pd(111). ⺠Estimated diffusion barriers of adsorbates on Pd(111). ⺠Evaluated thermochemistry for NO, CO, N2, NH3, and CH4 decomposition on Pd(111).
Keywords
Related Topics
Physical Sciences and Engineering
Chemistry
Physical and Theoretical Chemistry
Authors
Jeffrey A. Herron, Scott Tonelli, Manos Mavrikakis,