nr |
titel |
auteur |
tijdschrift |
jaar |
jaarg. |
afl. |
pagina('s) |
type |
1 |
A density functional theory study applied for carbon and oxygen isotope effects in the system Ni(CO)4/CO
|
Ono, Yuriko |
|
2004 |
390 |
4-6 |
p. 421-426 6 p. |
artikel |
2 |
A molecular dynamics study on the conformational stability of PrP 180–193 helix II prion fragment
|
Pappalardo, M. |
|
2004 |
390 |
4-6 |
p. 511-516 6 p. |
artikel |
3 |
An efficient algorithm for calculating whole-profile functions in crystal structure solution from powder diffraction data
|
Habershon, Scott |
|
2004 |
390 |
4-6 |
p. 394-398 5 p. |
artikel |
4 |
A new alligator-clip compound for molecular electronics
|
Jacob, Timo |
|
2004 |
390 |
4-6 |
p. 352-357 6 p. |
artikel |
5 |
A periodic first principle study to design microporous crystal 12MO, 7Al2O3 for selective and active O− radicals encaging
|
Chatterjee, Abhijit |
|
2004 |
390 |
4-6 |
p. 335-339 5 p. |
artikel |
6 |
Author index
|
|
|
2004 |
390 |
4-6 |
p. 522-530 9 p. |
artikel |
7 |
CCSDT and CCSD(T) calculations on model H-bonded and stacked complexes
|
Pittner, Jiřı́ |
|
2004 |
390 |
4-6 |
p. 496-499 4 p. |
artikel |
8 |
Charge separation at the rutile/anatase interface: a dominant factor of photocatalytic activity
|
Miyagi, Takahira |
|
2004 |
390 |
4-6 |
p. 399-402 4 p. |
artikel |
9 |
Comparison between semiclassical and composite absorbing potentials
|
Muga, J.G. |
|
2004 |
390 |
4-6 |
p. 454-457 4 p. |
artikel |
10 |
Complexes of cationic coinage metal clusters M n + (M=Cu, Ag, Au; n=1–4) and H2S: a theoretical study
|
Hamilton, I.P. |
|
2004 |
390 |
4-6 |
p. 517-521 5 p. |
artikel |
11 |
Degradation of vitamin C by low-energy electrons
|
Abdoul-Carime, Hassan |
|
2004 |
390 |
4-6 |
p. 481-484 4 p. |
artikel |
12 |
Determination of the first ionization energy of furan (C4H4O) from an extrapolation of two nd Rydberg series observed in the mass-resolved (2+1) resonance enhanced multiphoton ionization spectrum
|
Ridley, Trevor |
|
2004 |
390 |
4-6 |
p. 376-379 4 p. |
artikel |
13 |
Editorial board
|
|
|
2004 |
390 |
4-6 |
p. IFC- 1 p. |
artikel |
14 |
Electron-ion recombination in dense gaseous and liquid argon: effects due to argon cation clusters allow to explain the experimental data
|
Wojcik, Mariusz |
|
2004 |
390 |
4-6 |
p. 475-480 6 p. |
artikel |
15 |
Endohedral complexes of C58 cage with H2 and CO
|
Hang Hu, Yun |
|
2004 |
390 |
4-6 |
p. 472-474 3 p. |
artikel |
16 |
Energy distributions of CO produced in an acetone-containing discharge
|
Li, Peng |
|
2004 |
390 |
4-6 |
p. 323-327 5 p. |
artikel |
17 |
Evidence for two light-induced metastable states in Cl3[Ru(NH3)5NO]H2O
|
Schaniel, D. |
|
2004 |
390 |
4-6 |
p. 347-351 5 p. |
artikel |
18 |
Force acting on the microparticles in electrorheological solids under the application of a nonuniform ac electric field
|
Huang, J.P. |
|
2004 |
390 |
4-6 |
p. 380-383 4 p. |
artikel |
19 |
Identification of the point defects in diamond as measured by Raman spectroscopy: comparison between experiment and computation
|
Prawer, S. |
|
2004 |
390 |
4-6 |
p. 458-461 4 p. |
artikel |
20 |
Impact of receptor conformation on in silico screening performance
|
Merlitz, H. |
|
2004 |
390 |
4-6 |
p. 500-505 6 p. |
artikel |
21 |
Impedance spectroscopy of the electrode-tissue interface of living heart with isoösmotic conductivity perturbation
|
Ovadia, Marc |
|
2004 |
390 |
4-6 |
p. 445-453 9 p. |
artikel |
22 |
In situ characterization of surface physicochemical properties of carbon nanofibers using 1-naphthol as a fluorescent probe
|
Nishikiori, Hiromasa |
|
2004 |
390 |
4-6 |
p. 389-393 5 p. |
artikel |
23 |
Intermediate phase upon alloying Au–Ag nanoparticles under laser exposure of the mixture of individual colloids
|
Izgaliev, A.T. |
|
2004 |
390 |
4-6 |
p. 467-471 5 p. |
artikel |
24 |
Nano-scale effects in electrochemistry
|
Meier, J. |
|
2004 |
390 |
4-6 |
p. 440-444 5 p. |
artikel |
25 |
Near infrared absorptions of CH4/He plasma: the Phillips band system of C2
|
Chan, Man-Chor |
|
2004 |
390 |
4-6 |
p. 340-346 7 p. |
artikel |
26 |
Newly developed ab initio fitted potentials for molecular dynamics simulations of n-pentane in the zeolite silicalite-1
|
Loisruangsin, A |
|
2004 |
390 |
4-6 |
p. 485-490 6 p. |
artikel |
27 |
Nuclear magnetic resonance shielding tensors calculated with kinetic energy density-dependent exchange-correlation functionals
|
Maximoff, Sergey N. |
|
2004 |
390 |
4-6 |
p. 408-412 5 p. |
artikel |
28 |
Partially and fully deprotonated sulfuric acid in H2SO4(H2O) n (n=6–9) clusters
|
Ding, Chang-Geng |
|
2004 |
390 |
4-6 |
p. 307-313 7 p. |
artikel |
29 |
Solvent-mediated tautomerization of purine: single to quadruple proton transfer
|
Ahn, Doo-Sik |
|
2004 |
390 |
4-6 |
p. 384-388 5 p. |
artikel |
30 |
State-to-state dissociation rate coefficients in electronically excited diatomic gases
|
Aliat, A. |
|
2004 |
390 |
4-6 |
p. 370-375 6 p. |
artikel |
31 |
Structural evolutions of carbon nano-peapods under electron microscopic observation
|
Gloter, Alexandre |
|
2004 |
390 |
4-6 |
p. 462-466 5 p. |
artikel |
32 |
Switching dynamics of the photochromic 1,1-dicyano-2-(4-cyanophenyl)-1,8a-dihydroazulene probed by sub-30 fs spectroscopy
|
De Waele, Vincent |
|
2004 |
390 |
4-6 |
p. 328-334 7 p. |
artikel |
33 |
The entry pathway of O2 into human ferritin
|
Ciacchi, Lucio Colombi |
|
2004 |
390 |
4-6 |
p. 491-495 5 p. |
artikel |
34 |
Theoretical calculational studies on the mechanism of thermal dissociations for RN3 (R=CH3, CH3CH2, (CH3)2CH, (CH3)3C)
|
Zeng, Yanli |
|
2004 |
390 |
4-6 |
p. 362-369 8 p. |
artikel |
35 |
The role of the 11Bu − state in carotenoid-to-bacteriochlorophyll singlet-energy transfer in the LH2 antenna complexes from Rhodobacter sphaeroides G1C, Rhodobacter sphaeroides 2.4.1, Rhodospirillum molischianum and Rhodopseudomonas acidophila
|
Rondonuwu, Ferdy S. |
|
2004 |
390 |
4-6 |
p. 314-322 9 p. |
artikel |
36 |
The role of vacancy defects and holes in the fracture of carbon nanotubes
|
Mielke, Steven L. |
|
2004 |
390 |
4-6 |
p. 413-420 8 p. |
artikel |
37 |
Time resolved resonance Raman studies on triplet excited state of 2-methoxy-naphthalene by photo-sensitization
|
Mohapatra, Himansu |
|
2004 |
390 |
4-6 |
p. 427-432 6 p. |
artikel |
38 |
Towards the understanding of the spectroscopic behaviour of the C–H oscillator in C–H⋯O hydrogen bonds: the effect of solvent polarity
|
Ribeiro-Claro, Paulo J.A. |
|
2004 |
390 |
4-6 |
p. 358-361 4 p. |
artikel |
39 |
Two-photon absorption investigation in reduced and oxidized cytochrome c solutions
|
Andrade, A.A. |
|
2004 |
390 |
4-6 |
p. 506-510 5 p. |
artikel |
40 |
Two-photon absorption properties of star-shaped molecules containing peripheral diarylthienylamines
|
Liu, Sean |
|
2004 |
390 |
4-6 |
p. 433-439 7 p. |
artikel |
41 |
Yb3+ ion as a sensitizer for the upconversion luminescence in nanocrystalline Gd3Ga5O12:Ho3+
|
Boyer, J.C. |
|
2004 |
390 |
4-6 |
p. 403-407 5 p. |
artikel |