Integrating the Car-Parrinello equations. III. Techniques for ultrasoft pseudopotentials
- Jürg Hutter
- Mark Tuckerman
- et al.
- 1995
- The Journal of Chemical Physics
Publications
17 results for Mark E. Tuckerman
Ab initio molecular dynamics simulation of the solvation and transport of hydronium and hydroxyl ions in water
- M. Tuckerman
- K. Laasonen
- et al.
- 1995
- The Journal of Chemical Physics
Ab initio simulations of water and water ions
- M. Tuckerman
- K. Laasonen
- et al.
- 1994
- Journal of Physics: Condensed Matter
Integrating the Car-Parrinello equations. II. Multiple time scale techniques
- Mark E. Tuckerman
- Michele Parrinello
- 1994
- The Journal of Chemical Physics
Integrating the Car-Parrinello equations. I. Basic integration techniques
- Mark E. Tuckerman
- Michele Parrinello
- 1994
- The Journal of Chemical Physics
Multiple time scale simulation of a flexible model of CO2
- Mark E. Tuckerman
- Walter Langel
- 1994
- The Journal of Chemical Physics
Molecular dynamics algorithm for multiple time scales: Systems with disparate masses
- Mark E. Tuckerman
- Bruce J. Berne
- et al.
- 1991
- The Journal of Chemical Physics