𝔖 Bobbio Scriptorium
✦   LIBER   ✦

Quantum Chemistry Based Statistical Mechanical Model of Hydrogen Desorption from Si(100)-2 × 1, Ge(100)-2 × 1, and SiGe Alloy Surfaces

✍ Scribed by Mui, Collin; Bent, Stacey F.; Musgrave, Charles B.

Book ID
127168569
Publisher
American Chemical Society
Year
2004
Tongue
English
Weight
201 KB
Volume
108
Category
Article
ISSN
0022-3654

No coin nor oath required. For personal study only.

📜 SIMILAR VOLUMES

Adsorption of hydrogen atoms on the Si(1
Adsorption of hydrogen atoms on the Si(100)-2×1 surface: implications for the H2 desorption mechanism
✍ Christine J. Wu; Emily A. Carter 📂 Article 📅 1991 🏛 Elsevier Science 🌐 English ⚖ 558 KB

The adsorption of atomic hydrogen on the reconstructed Si ( lOO)-2 x I surface is studied using embedded Si clusters as models of an extended Si surface. Analytic gradients of generalized valence bond (GVB) wavefunctions are used to predict equilibrium structures and harmonic vibrational frequencies