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LCGTO-Xα model cluster study for the chemisorption of CO on twofold sites of Ni surfaces

✍ Scribed by H. Jörg; N. Rösch


Book ID
118986485
Publisher
Elsevier Science
Year
1985
Tongue
English
Weight
416 KB
Volume
163
Category
Article
ISSN
0039-6028

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Shape resonance energies in the Xα scatt
✍ A. Schichl; D. Menzel; N. Rōsch 📂 Article 📅 1984 🏛 Elsevier Science 🌐 English ⚖ 464 KB

XO~ scattered-wave calculations have been performed to compare the photon energy dependence of rhe valence level photoionization CIOSS sections of molecular CO and N2 and of Ni clusters simulatmg the adsorption of these molecules in the range of the shape resonances. Care has to be taken to avoid mu