CARBON MONOXIDE INTERACTION WITH PALLADIUM SURFACE
UDC 541.128
Keywords:
-Abstract
Activation desorption energy were calculated by Hartree-Fock self-consistent field method in "sbkjc" basis set for CO on Pd surface. Two different forms (twofold and threefold) of carbon monoxide adsorbs on palladium surface. The calculated data agrees good with experimental data.
References
1. Гончарук, В.В., Качалов, Г.Л., Ковтун, Г.А., Рудаков, Е.С., Яцимирский, В.К. Катализ. Механизмы гомогенного и гетерогенного катализа, кластерные подходы. – К.: Наукова думка, 2002. – 541 с.
2. Крылов, О.В. гетерогенный катализ. – М: Академкнига, 2004.- 679 с.
3. Cvetanovic, R.J., Amenomiya, Y.A. Temperature programmed desorption technique for investigation of practical catalysis // Catalysis Reviews. - 1972. - 6. - P. 21-49.
4. Hofman, F.M. Infrared reflection-adsorption spectroscopy of adsorbed molecules // Surf.Sci.Rep. - 1983. –Vol. 3. - P. 107-192.
5. Kato Hiroyuki, Yoshinobu Jun, Kawai Maki. Determination of six types of vibrational mode for bridge CO on Pd (110) // Surf. Sci. - 1999. – Vol. 427-428. - P. 69-73.
6. Loffreda, D., Simon, D., Sautet, P. Dependence of stretching frequency on surface coverage and adsorbate - adsorbate interactions: a density – functional theory approach of CO on Pd (111) // Surf.Sci. - 1999. – Vol. 425. - P. 68-80.
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Copyright (c) 2009 А. Яцимирський, канд. хім. наук, О. Іщенко, д-р. хім. наук, проф., Т. Шкода, асп.
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