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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122 results for Alessandro Curioni

DFT-based molecular dynamics as a new tool for computational biology: First applications and perspective
- - W. Andreoni
  - A. Curioni
  - et al.
- 2001
- IBM J. Res. Dev
Computer simulations for organic light-emitting diodes
- - A. Curioni
  - W. Andreoni
- 2001
- IBM J. Res. Dev
Density-functional theory and car-parinello study of electronic, structural, and dynamical properties of the hexapyrrole molecule
- - Renato Colle
  - Alessandro Curioni
- 2000
- Journal of Physical Chemistry A
Organic-cathode interface in Alq₃-based organic light-emitting devices: new insights from ab-initio molecular dynamics
- - Alessandro Curioni
  - Wanda Andreoni
- 2000
- Synthetic Metals
Density functional theory approach to thiols and disulfides on gold: Au(111) surface and clusters
- - Wanda Andreoni
  - Alessandro Curioni
  - et al.
- 2000
- International Journal of Quantum Chemistry
New advances in chemistry and materials science with CPMD and parallel computing
- - Wanda Andreoni
  - Alessandro Curioni
- 2000
- Parallel Computing
Atom-resolved electronic spectra for Alq₃ from theory and experiment
- - A. Curioni
  - W. Andreoni
  - et al.
- 1998
- Applied Physics Letters
Alq ₃ : Ab initio calculations of its structural and electronic properties in neutral and charged states
- - Alessandro Curioni
  - Mauro Boero
  - et al.
- 1998
- Chemical Physics Letters
Lithium-aluminum contacts for organic light-emitting devices
- - E.I. Haskal
  - A. Curioni
  - et al.
- 1997
- Applied Physics Letters
Chemical shifts of diamagnetic azafullerenes: (C₅₉N) ₂ and C₅₉HN
- - Michael Bühl
  - Alessandro Curioni
  - et al.
- 1997
- Chemical Physics Letters