Using first-principles total-energy CalCUlatiOnS the lattice relaxation, surface energy, work function and surface phonons have been determined for the Pt( 100)-surface. Calculation of forces allows for a very efficient determination of equilibrium geometries and interplanar force constants. Results
β¦ LIBER β¦
Structure and dynamics at the Pd(100) surface
β Scribed by A Wachter; K.P Bohnen; K.M Ho
- Book ID
- 116067960
- Publisher
- Elsevier Science
- Year
- 1996
- Tongue
- English
- Weight
- 771 KB
- Volume
- 346
- Category
- Article
- ISSN
- 0039-6028
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