| nr |
titel |
auteur |
tijdschrift |
jaar |
jaarg. |
afl. |
pagina('s) |
type |
| 1 |
Ab initio path integral ring polymer molecular dynamics: Vibrational spectra of molecules
|
Shiga, Motoyuki
|
|
2008
|
451 |
4-6 |
p. 175-181
7 p.
|
artikel
|
| 2 |
Analysis of experimental X-ray scattering from almost spherical molecules: Estimates of the influence of the force - ∂ V xc / ∂ r , where V xc ( r ) is the exchange-correlation potential of DFT for CH 4 and NH 4 +
|
Van Alsenoy, C.
|
|
2008
|
451 |
4-6 |
p. 309-315
7 p.
|
artikel
|
| 3 |
A non-equilibrium multiscale simulation paradigm
|
Li, Shaofan
|
|
2008
|
451 |
4-6 |
p. 293-300
8 p.
|
artikel
|
| 4 |
A semi-classical XOR logic gate integrated in a single molecule
|
Jlidat, N.
|
|
2008
|
451 |
4-6 |
p. 270-275
6 p.
|
artikel
|
| 5 |
Author Index
|
|
|
2008
|
451 |
4-6 |
p. 321-326
6 p.
|
artikel
|
| 6 |
Contents
|
|
|
2008
|
451 |
4-6 |
p. iii-ix
nvt p.
|
artikel
|
| 7 |
Editorial Board
|
|
|
2008
|
451 |
4-6 |
p. IFC-
1 p.
|
artikel
|
| 8 |
Electrical fluctuations in monolayer-protected metal nanoclusters
|
Cervera, Javier
|
|
2008
|
451 |
4-6 |
p. 257-261
5 p.
|
artikel
|
| 9 |
Evidence of Lyman transitions of high rovibrationally excited HD and D2 detected by laser induced fluorescence in the VUV
|
Gabriel, O.
|
|
2008
|
451 |
4-6 |
p. 204-208
5 p.
|
artikel
|
| 10 |
Fluorine K-shell photoelectron angular distribution from CF4 molecules in the molecular frame
|
Fukuzawa, H.
|
|
2008
|
451 |
4-6 |
p. 182-185
4 p.
|
artikel
|
| 11 |
How the site of ionisation influences side-chain fragmentation in histidine radical cation
|
Gil, Adrià
|
|
2008
|
451 |
4-6 |
p. 276-281
6 p.
|
artikel
|
| 12 |
In situ observation of photocatalytic reaction by photoacoustic spectroscopy: Detection of heat of exothermic photocatalytic reaction
|
Murakami, Naoya
|
|
2008
|
451 |
4-6 |
p. 316-320
5 p.
|
artikel
|
| 13 |
Intermolecular resonant energy transfer of oligo(p-phenylenevinylene)–fullerene dyads: A theoretical study
|
Toivonen, Teemu L.J.
|
|
2008
|
451 |
4-6 |
p. 243-248
6 p.
|
artikel
|
| 14 |
Kinetic and modeling studies on ETBE pyrolysis behind reflected shock waves
|
Yasunaga, Kenji
|
|
2008
|
451 |
4-6 |
p. 192-197
6 p.
|
artikel
|
| 15 |
Micellar effects upon the forward and reverse processes corresponding to the reaction between acetonitrile pentacyanoferrate(II) and pentaamminepyrazineruthenium(II)
|
Jimenez, R.
|
|
2008
|
451 |
4-6 |
p. 252-256
5 p.
|
artikel
|
| 16 |
Molecular dynamics simulation of chiral chromatography
|
Šebestík, Jaroslav
|
|
2008
|
451 |
4-6 |
p. 233-236
4 p.
|
artikel
|
| 17 |
Molecular surface-free continuum model for electrodiffusion processes
|
Lu, Benzhuo
|
|
2008
|
451 |
4-6 |
p. 282-286
5 p.
|
artikel
|
| 18 |
Properties and electronic structure of heavily oxygen-doped GaN crystals
|
Miura, Akira
|
|
2008
|
451 |
4-6 |
p. 222-225
4 p.
|
artikel
|
| 19 |
Purple-to-yellow tunable luminescence of Ce3+ doped yttrium–silicon–oxide–nitride phosphors
|
Yang, Hucheng
|
|
2008
|
451 |
4-6 |
p. 218-221
4 p.
|
artikel
|
| 20 |
Quantum chemical and RRKM/master equation studies of isoprene ozonolysis: Methacrolein and methacrolein oxide
|
Kuwata, Keith T.
|
|
2008
|
451 |
4-6 |
p. 186-191
6 p.
|
artikel
|
| 21 |
Solvation dynamics of LDS 750 in micelles, reverse micelles and proteins
|
Banerjee, Debapriya
|
|
2008
|
451 |
4-6 |
p. 237-242
6 p.
|
artikel
|
| 22 |
Solvent effects on zero-point vibrational corrections to optical rotations and nuclear magnetic resonance shielding constants
|
Kongsted, Jacob
|
|
2008
|
451 |
4-6 |
p. 226-232
7 p.
|
artikel
|
| 23 |
Spin–Spin interactions in polynuclear transition-metal complexes
|
Podewitz, Maren
|
|
2008
|
451 |
4-6 |
p. 301-308
8 p.
|
artikel
|
| 24 |
Structures and energetics of Gly–(H2O)5: Thermodynamic and kinetic stabilities
|
Kim, Ju-Young
|
|
2008
|
451 |
4-6 |
p. 198-203
6 p.
|
artikel
|
| 25 |
Testing the combination of Hartree–Fock exchange and Wilson–Levy correlation for weakly bonded extended systems
|
Civalleri, B.
|
|
2008
|
451 |
4-6 |
p. 287-292
6 p.
|
artikel
|
| 26 |
The low lying isomers of the copper nonamer cluster, Cu9
|
Assadollahzadeh, Behnam
|
|
2008
|
451 |
4-6 |
p. 262-269
8 p.
|
artikel
|
| 27 |
Thermal diffusion factor of model 2CLJD mixtures from non-equilibrium molecular dynamics
|
Yeganegi, Saeed
|
|
2008
|
451 |
4-6 |
p. 209-212
4 p.
|
artikel
|
| 28 |
Third-order nonlinear optical properties of a new copper coordination compound: A promising candidate for all-optical switching
|
Huang, Ting
|
|
2008
|
451 |
4-6 |
p. 213-217
5 p.
|
artikel
|
| 29 |
Vibrational properties of semitrimer picotubes
|
Rosenkranz, N.
|
|
2008
|
451 |
4-6 |
p. 249-251
3 p.
|
artikel
|
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