| nr |
titel |
auteur |
tijdschrift |
jaar |
jaarg. |
afl. |
pagina('s) |
type |
| 1 |
Ab initio MO calculations of hyperfine coupling constants of hydronium radical H3O
|
Tachikawa, Hiroto
|
|
2001
|
335 |
3-4 |
p. 305-310
6 p.
|
artikel
|
| 2 |
Ab initio study of the energetics and thermodynamics of hydrogen abstraction from fluoromethanes by O(3P). II: CF n H 4−n+O(3 P)→CF n H 4−n…O→ CF n H 3−n+ OH (n=0,1,2)
|
Kreye, W.C.
|
|
2001
|
335 |
3-4 |
p. 257-264
8 p.
|
artikel
|
| 3 |
Analytic gradient for the relativistic elimination of small components (RESCs) approach
|
Fedorov, Dmitri G.
|
|
2001
|
335 |
3-4 |
p. 183-187
5 p.
|
artikel
|
| 4 |
A non-perturbative cumulant expansion method for the grand partition function of quantum systems
|
Mandal, Sheikh Hannan
|
|
2001
|
335 |
3-4 |
p. 281-288
8 p.
|
artikel
|
| 5 |
A novel propagator approach for NMR signal attenuation due to anisotropic diffusion under various magnetic field gradients
|
Lin, Guoxing
|
|
2001
|
335 |
3-4 |
p. 249-256
8 p.
|
artikel
|
| 6 |
Charge distributions in water and ion–water clusters
|
Rashin, A.A.
|
|
2001
|
335 |
3-4 |
p. 327-333
7 p.
|
artikel
|
| 7 |
Classical irregular scattering and fluctuation of quantum transition probability
|
Takahashi, Seiji
|
|
2001
|
335 |
3-4 |
p. 241-248
8 p.
|
artikel
|
| 8 |
Coadsorption of water monomers with CO on Ru(001) and charge transfer during hydration processes
|
Nakamura, Masashi
|
|
2001
|
335 |
3-4 |
p. 170-175
6 p.
|
artikel
|
| 9 |
Controlled growth of carbon nanotubes on graphite foil by chemical vapor deposition
|
Li, W.Z
|
|
2001
|
335 |
3-4 |
p. 141-149
9 p.
|
artikel
|
| 10 |
C-REDOR: rotational echo double resonance under very fast magic-angle spinning
|
Chan, Jerry C.C.
|
|
2001
|
335 |
3-4 |
p. 289-297
9 p.
|
artikel
|
| 11 |
Cross-sections for electron scattering by O2 at intermediate and high energies, 0.1–10 keV
|
Garcı́a, G.
|
|
2001
|
335 |
3-4 |
p. 227-233
7 p.
|
artikel
|
| 12 |
Decomposition mechanism of the polynitrogen N5 and N6 clusters and their ions
|
Nguyen, Minh Tho
|
|
2001
|
335 |
3-4 |
p. 311-320
10 p.
|
artikel
|
| 13 |
Effect of the C/O ratio on the C60 and C70 formation rates in soot synthesised by laser pyrolysis of benzene-based mixtures
|
Ténégal, F
|
|
2001
|
335 |
3-4 |
p. 155-162
8 p.
|
artikel
|
| 14 |
Fluorine chemical shift tensors in substituted fluorobenzenes using cross correlations in NMR relaxation
|
Dorai, Kavita
|
|
2001
|
335 |
3-4 |
p. 176-182
7 p.
|
artikel
|
| 15 |
Formation and characterization of the AsCO and AsCO− molecules. A matrix isolation FTIR and theoretical study
|
Zhang, Luning
|
|
2001
|
335 |
3-4 |
p. 334-338
5 p.
|
artikel
|
| 16 |
Geometry optimization of solids using delocalized internal coordinates
|
Andzelm, Jan
|
|
2001
|
335 |
3-4 |
p. 321-326
6 p.
|
artikel
|
| 17 |
Infrared absorption spectroscopy of Ar–12C18O2: change in the intramolecular potential upon complex formation
|
Ozaki, Yasushi
|
|
2001
|
335 |
3-4 |
p. 188-194
7 p.
|
artikel
|
| 18 |
Observation of the A ̃ − X ̃ electronic transition of the CF3O2 radical
|
Zalyubovsky, Sergey J.
|
|
2001
|
335 |
3-4 |
p. 298-304
7 p.
|
artikel
|
| 19 |
One-dimensional discrete maps for periodic laser forcing on electrochemical oscillators
|
Karantonis, Antonis
|
|
2001
|
335 |
3-4 |
p. 221-226
6 p.
|
artikel
|
| 20 |
On the role of interaction anisotropy in vibrational relaxation of HF and HCl by Ar
|
Krems, Roman V.
|
|
2001
|
335 |
3-4 |
p. 273-280
8 p.
|
artikel
|
| 21 |
On the use of two-photon absorption for determination of femtosecond pump–probe cross-correlation functions
|
Rasmusson, Marcus
|
|
2001
|
335 |
3-4 |
p. 201-208
8 p.
|
artikel
|
| 22 |
Optical heterodyne signal generation and detection in cavity ringdown spectroscopy based on a rapidly swept cavity
|
He, Yabai
|
|
2001
|
335 |
3-4 |
p. 215-220
6 p.
|
artikel
|
| 23 |
“Orientational melting of two-shell carbon nanoparticles: molecular dynamics study” [Chemical Physics Letters 328 (2000) 355–362]
|
Lozovik, Yu.E
|
|
2001
|
335 |
3-4 |
p. 348-
1 p.
|
artikel
|
| 24 |
Rotationally resolved electronic spectroscopy of aniline excited vibronic levels
|
Pietraperzia, Giangaetano
|
|
2001
|
335 |
3-4 |
p. 195-200
6 p.
|
artikel
|
| 25 |
Self-guided molecular dynamics in the isothermal–isobaric ensemble
|
Shinoda, Wataru
|
|
2001
|
335 |
3-4 |
p. 265-272
8 p.
|
artikel
|
| 26 |
Structure of La2@C80 studied by La K-edge XAFS
|
Kubozono, Y
|
|
2001
|
335 |
3-4 |
p. 163-169
7 p.
|
artikel
|
| 27 |
Unit building block of the oligomeric chlorosomal antenna of the green photosynthetic bacterium Chloroflexus aurantiacus: modeling of nonlinear optical spectra
|
Novoderezhkin, Vladimir
|
|
2001
|
335 |
3-4 |
p. 234-240
7 p.
|
artikel
|
| 28 |
Vertical aligned carbon nanotubes grown on Au film and reduction of threshold field in field emission
|
Cao, Anyuan
|
|
2001
|
335 |
3-4 |
p. 150-154
5 p.
|
artikel
|
| 29 |
Vibrationally excited state spectroscopy of radicals in a supersonic plasma
|
Bazalgette Courrèges-Lacoste, G.
|
|
2001
|
335 |
3-4 |
p. 209-214
6 p.
|
artikel
|
| 30 |
VTST kinetics study of the N(2 D)+O 2(X 3Σ g −)→ NO(X 2Π)+O(3 P,1 D) reactions based on CASSCF and CASPT2 ab initio calculations including excited potential energy surfaces
|
González, Miguel
|
|
2001
|
335 |
3-4 |
p. 339-347
9 p.
|
artikel
|
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