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 |