| nr |
titel |
auteur |
tijdschrift |
jaar |
jaarg. |
afl. |
pagina('s) |
type |
| 1 |
Ab initio calculation of the structural and dynamical properties of layered semiconductors
|
Adler, Christoph
|
|
2001
|
20 |
3-4 |
p. 371-375
5 p.
|
artikel
|
| 2 |
A new constant-pressure ab initio/classical molecular dynamics method: simulation of pressure-induced amorphization in a Si35H36 cluster
|
Martoňák, R.
|
|
2001
|
20 |
3-4 |
p. 293-299
7 p.
|
artikel
|
| 3 |
An optimal procedure to extract interaction potentials for protein folding
|
Micheletti, C.
|
|
2001
|
20 |
3-4 |
p. 305-310
6 p.
|
artikel
|
| 4 |
Atomic and electronic structure of high-energy grain boundaries in silicon and carbon
|
Cleri, Fabrizio
|
|
2001
|
20 |
3-4 |
p. 351-362
12 p.
|
artikel
|
| 5 |
Atom manipulation with the STM: nanostructuring, tip functionalization, and femtochemistry
|
Meyer, Gerhard
|
|
2001
|
20 |
3-4 |
p. 443-450
8 p.
|
artikel
|
| 6 |
Author index to volume 20
|
|
|
2001
|
20 |
3-4 |
p. 457-459
3 p.
|
artikel
|
| 7 |
Computer simulation of the quartz surface: a combined ab initio and empirical potential approach
|
Koudriachova, M.V.
|
|
2001
|
20 |
3-4 |
p. 381-386
6 p.
|
artikel
|
| 8 |
Contents
|
|
|
2001
|
20 |
3-4 |
p. v-vi
nvt p.
|
artikel
|
| 9 |
Defect properties and diffusion in sodium using ab initio molecular dynamics
|
Smargiassi, Enrico
|
|
2001
|
20 |
3-4 |
p. 416-422
7 p.
|
artikel
|
| 10 |
Diffusion and Island formation on the ice Ih basal plane surface
|
Batista, Enrique R.
|
|
2001
|
20 |
3-4 |
p. 325-336
12 p.
|
artikel
|
| 11 |
Electrical instability of thin films driven by Joule heating
|
Pennetta, C
|
|
2001
|
20 |
3-4 |
p. 451-455
5 p.
|
artikel
|
| 12 |
Empirical force field for the simulation of a class of chromophores in a photosynthetic center
|
Ceccarelli, Matteo
|
|
2001
|
20 |
3-4 |
p. 318-324
7 p.
|
artikel
|
| 13 |
First-principles study of Raman intensities in semiconductor systems
|
Pavone, Pasquale
|
|
2001
|
20 |
3-4 |
p. 363-370
8 p.
|
artikel
|
| 14 |
Ground-state properties and excitation energies of cubic SrO and MgO
|
Cappellini, Giancarlo
|
|
2001
|
20 |
3-4 |
p. 401-406
6 p.
|
artikel
|
| 15 |
Magnetism of rough overlayers – an augmented space recursive study
|
Sanyal, Biplab
|
|
2001
|
20 |
3-4 |
p. 429-435
7 p.
|
artikel
|
| 16 |
Many-body effects on one-electron energies and wave functions in low-dimensional systems
|
Pulci, Olivia
|
|
2001
|
20 |
3-4 |
p. 300-304
5 p.
|
artikel
|
| 17 |
Modelling photoreactions in proteins by density functional theory
|
Molteni, C.
|
|
2001
|
20 |
3-4 |
p. 311-317
7 p.
|
artikel
|
| 18 |
New perspectives for the Barkhausen effect
|
Zapperi, Stefano
|
|
2001
|
20 |
3-4 |
p. 436-442
7 p.
|
artikel
|
| 19 |
Preface
|
|
|
2001
|
20 |
3-4 |
p. vii-
1 p.
|
artikel
|
| 20 |
Self-diffusion of silicon in TiSi2 competing phases by tight-binding molecular dynamics
|
Iannuzzi, Marcella
|
|
2001
|
20 |
3-4 |
p. 394-400
7 p.
|
artikel
|
| 21 |
SO2Cl2, SOCl2: energy dispersive X-ray diffraction, ab initio and molecular dynamics calculation
|
Meloni, S.
|
|
2001
|
20 |
3-4 |
p. 407-415
9 p.
|
artikel
|
| 22 |
Stress and reconstruction on (001) transition-metal surfaces
|
Filippetti, Alessio
|
|
2001
|
20 |
3-4 |
p. 423-428
6 p.
|
artikel
|
| 23 |
Surface charge density waves and the Mott insulators for 3 × 3 adlayers on (111) semiconductor surfaces
|
Santoro, Giuseppe
|
|
2001
|
20 |
3-4 |
p. 343-350
8 p.
|
artikel
|
| 24 |
The activation–relaxation technique: an efficient algorithm for sampling energy landscapes
|
Barkema, G.T
|
|
2001
|
20 |
3-4 |
p. 285-292
8 p.
|
artikel
|
| 25 |
Theoretical investigation of the lattice dynamics of GaAlSb superlattices
|
Steininger, Bernhard
|
|
2001
|
20 |
3-4 |
p. 376-380
5 p.
|
artikel
|
| 26 |
Thermodynamic behavior of a carbon schwarzite
|
Rosato, Vittorio
|
|
2001
|
20 |
3-4 |
p. 387-393
7 p.
|
artikel
|
| 27 |
Wannier functions characterization of floating bonds in a-Si
|
Fornari, M.
|
|
2001
|
20 |
3-4 |
p. 337-342
6 p.
|
artikel
|
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