Microscopic struture of amorphous covalent alloys probed by ab initio molecular dynamics: SiC
- Fabio Finocchi
- Giulia Galli
- et al.
- 1992
- Physical Review Letters
Publications
77 results for Michele Parrinello
Alkali adsorption on Si(111) surfaces: ab initio molecular dynamics studies
- Isabelle Moullet
- Wanda Andreoni
- et al.
- 1992
- Surface Science
Adiabaticity in first-principles molecular dynamics
- Peter E. Blöchl
- M. Parrinello
- 1992
- Physical Review B
Impurity states in doped fullerenes: C59B and C59N
- Wanda Andreoni
- François Gygi
- et al.
- 1992
- Chemical Physics Letters
Doping-induced distortions and bonding in K6C60 and Rb6C60
- Wanda Andreoni
- François Gygi
- et al.
- 1992
- Physical Review Letters
Structural and electronic properties of C70
- Wanda Andreoni
- François Gygi
- et al.
- 1992
- Chemical Physics Letters
Amorphous silicon studied by ab initio molecular dynamics: Preparation, structure, and properties
- I. Åtich
- R. Car
- et al.
- 1991
- Physical Review B
Structure of hydrogenated amorphous silicon from ab initio molecular dynamics
- F. Buda
- Guido L. Chiarotti
- et al.
- 1991
- Physical Review B
Structural, bonding, dynamical, and electronic properties of liquid silicon: An ab initio molecular-dynamics study
- I. Atich
- R. Car
- et al.
- 1991
- Physical Review B
Electronic and vibrational properties of C60 at finite temperature from ab initio molecular dynamics
- Bradley P. Feuston
- Wanda Andreoni
- et al.
- 1991
- Physical Review B