The adiabatic molecule–metal surface interaction: Theoretical approaches

1999 ◽  
Vol 71 (1) ◽  
pp. 231-265 ◽  
Author(s):  
G. P. Brivio ◽  
M. I. Trioni
Keyword(s):  
Metal Surface ◽  
Surface Interaction ◽  
Theoretical Approaches

Ion-Impact-Induced Strong Metal Surface Interaction in Pt/TiO2(110)

2012 ◽  
Vol 116 (44) ◽  
pp. 23377-23382 ◽  
Author(s):  
A. B. Arjad ◽  
J. A. Yarmoff
Keyword(s):  
Metal Surface ◽  
Surface Interaction ◽  
Ion Impact

Study of plasma formation in CW CO2 laser beam-metal surface interaction

1994 ◽  
Author(s):  
V. V. Azharonok ◽  
Zh V. Vasilchenko ◽  
Vladimir S. Golubev ◽  
A. N. Gresev ◽  
Alexandre M. Zabelin ◽  
...  
Keyword(s):  
Laser Beam ◽  
Metal Surface ◽  
Co2 Laser ◽  
Surface Interaction ◽  
Plasma Formation ◽  
Cw Co2 Laser

First Steps in the Adsorption of C5H8 on Pt(111)

2005 ◽  
Vol 3 (1) ◽  
Author(s):  
Sandra Simonetti ◽  
Graciela Brizuela
Keyword(s):  
Metal Surface ◽  
Theoretical Method ◽  
Surface Interaction ◽  
Geometrical Configuration

The adsorption of C5H8 on Pt(111) has been studied using a semiempirical theoretical method implemented with the YAeHMOP package. The energetic calculations show that the adsorption is weak. The adsorbate-surface interaction requires that both C-H and Pt-Pt bonds be weaken. The main interaction comes from the C and H nearest to the metal surface. The tilted geometrical configuration adopted by the molecule facilitates this interaction. The Pt-C and Pt-H interactions are mainly due to overlaps between the dz2 and pz metal orbitals and the C pz and H s orbitals, respectively.

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