Wanda Andreoni
Wanda Andreoni
Professor of Physics
Bestätigte E-Mail-Adresse bei
Zitiert von
Zitiert von
Thiols and disulfides on the Au (111) surface: the headgroup− gold interaction
H Grönbeck, A Curioni, W Andreoni
Journal of the American Chemical Society 122 (16), 3839-3842, 2000
The chemistry of water on alumina surfaces: Reaction dynamics from first principles
KC Hass, WF Schneider, A Curioni, W Andreoni
science 282 (5387), 265-268, 1998
Melting of small gold particles: Mechanism and size effects
F Ercolessi, W Andreoni, E Tosatti
Physical Review Letters 66 (7), 911, 1991
N-type organic thin-film transistor with high field-effect mobility based on a N, N′-dialkyl-3, 4, 9, 10-perylene tetracarboxylic diimide derivative
PRL Malenfant, CD Dimitrakopoulos, JD Gelorme, LL Kosbar, TO Graham, ...
Applied Physics Letters 80 (14), 2517-2519, 2002
Alq3: ab initio calculations of its structural and electronic properties in neutral and charged states
A Curioni, M Boero, W Andreoni
Chemical Physics Letters 294 (4-5), 263-271, 1998
Structural and electronic properties of sodium microclusters (n=2–20) at low and high temperatures: New insights from abinitio molecular dynamics studies
U Röthlisberger, W Andreoni
The Journal of chemical physics 94 (12), 8129-8151, 1991
Equilibrium structures and finite temperature properties of silicon microclusters from ab initio molecular-dynamics calculations
P Ballone, W Andreoni, R Car, M Parrinello
Physical review letters 60 (4), 271, 1988
Structure of nanoscale silicon clusters
U Röthlisberger, W Andreoni, M Parrinello
Physical review letters 72 (5), 665, 1994
Ab initio calculations of the quasiparticle and absorption spectra of clusters: the sodium tetramer
G Onida, L Reining, RW Godby, R Del Sole, W Andreoni
Physical review letters 75 (5), 818, 1995
Blue Gene: A vision for protein science using a petaflop supercomputer
F Allen, G Almasi, W Andreoni, D Beece, BJ Berne, A Bright, J Brunheroto, ...
IBM systems journal 40 (2), 310-327, 2001
First-principles calculations of self-diffusion constants in silicon
PE Blöchl, E Smargiassi, R Car, DB Laks, W Andreoni, ST Pantelides
Physical review letters 70 (16), 2435, 1993
First-Principles Molecular Dynamics Simulations of H2O on α-Al2O3 (0001)
KC Hass, WF Schneider, A Curioni, W Andreoni
The Journal of Physical Chemistry B 104 (23), 5527-5540, 2000
Structural and electronic properties of La@ C82
K Laasonen, W Andreoni, M Parrinello
Science 258 (5090), 1916-1918, 1992
New advances in chemistry and materials science with CPMD and parallel computing
W Andreoni, A Curioni
Parallel Computing 26 (7-8), 819-842, 2000
Atom-resolved electronic spectra for Alq3 from theory and experiment
A Curioni, W Andreoni, R Treusch, FJ Himpsel, E Haskal, P Seidler, ...
Applied physics letters 72 (13), 1575-1577, 1998
Efficient linear scaling geometry optimization and transition-state search for direct wavefunction optimization schemes in density functional theory using a plane-wave basis
SR Billeter, A Curioni, W Andreoni
Computational materials science 27 (4), 437-445, 2003
Impurity states in doped fullerenes: C59B and C59N
W Andreoni, F Gygi, M Parrinello
Chemical physics letters 190 (3-4), 159-162, 1992
Gold and platinum microclusters and their anions: comparison of structural and electronic properties
H Grönbeck, W Andreoni
Chemical Physics 262 (1), 1-14, 2000
Key Steps of the cis-Platin-DNA Interaction:  Density Functional Theory-Based Molecular Dynamics Simulations
P Carloni, M Sprik, W Andreoni
The Journal of Physical Chemistry B 104 (4), 823-835, 2000
Structural, electronic, and vibrational properties of Si(111)-2×1 from ab initio molecular dynamics
F Ancilotto, W Andreoni, A Selloni, R Car, M Parrinello
Physical review letters 65 (25), 3148, 1990
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