Publications

This is our catalog of publications authored by IBM researchers, in collaboration with the global research community. It’s an ever-growing body of work that shows why IBM is one of the most important contributors to modern computing.

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18 results for Jürg Hutter

Ab initio molecular dynamics simulation of liquid water: Comparison of three gradient-corrected density functionals
- - Michiel Sprik
  - Jürg Hutter
  - et al.
- 1996
- Journal of Chemical Physics
Carboplatin versus cisplatin: density functional approach to their molecular properties
- - Elena Tornaghi
  - Wanda Andreoni
  - et al.
- 1995
- Chemical Physics Letters
Density functional study of small aqueous Be²⁺ clusters
- - D. Marx
  - J. Hutter
  - et al.
- 1995
- Chemical Physics Letters
Structure and bonding in cisplatin and other Pt(II) complexes
- - Paolo Carloni
  - Wanda Andreoni
  - et al.
- 1995
- Chemical Physics Letters
Integrating the Car-Parrinello equations. III. Techniques for ultrasoft pseudopotentials
- - Jürg Hutter
  - Mark Tuckerman
  - et al.
- 1995
- The Journal of Chemical Physics
Electronic structure optimization in plane-wave-based density functional calculations by direct inversion in the iterative subspace
- - Jürg Hutter
  - Hans Peter Lüthi
  - et al.
- 1994
- Computational Materials Science
Exponential transformation of molecular orbitals
- - Jürg Hutter
  - Michele Parrinello
  - et al.
- 1994
- The Journal of Chemical Physics
The molecular structure of C₆: A theoretical investigation
- - Jürg Hutter
  - Hans Peter Lüthi
- 1994
- The Journal of Chemical Physics