| nr |
titel |
auteur |
tijdschrift |
jaar |
jaarg. |
afl. |
pagina('s) |
type |
| 1 |
Ab initio study of the hydrolysis of carbonyl difluoride (CF2O): importance of an additional water molecule
|
Uchimaru, Tadafumi
|
|
2004
|
396 |
1-3 |
p. 110-116
7 p.
|
artikel
|
| 2 |
A modified definition of the zeroth-order Hamiltonian in multiconfigurational perturbation theory (CASPT2)
|
Ghigo, Giovanni
|
|
2004
|
396 |
1-3 |
p. 142-149
8 p.
|
artikel
|
| 3 |
An interesting property of the Perdew–Wang 91 density functional
|
Langlet, J.
|
|
2004
|
396 |
1-3 |
p. 10-15
6 p.
|
artikel
|
| 4 |
A note on the electric multipole moments of carbon dioxide
|
Maroulis, George
|
|
2004
|
396 |
1-3 |
p. 66-68
3 p.
|
artikel
|
| 5 |
A TDDFT study of the ruthenium(II) polyazaaromatic complex [Ru(dppz)(phen)2]2+ in solution
|
Fantacci, Simona
|
|
2004
|
396 |
1-3 |
p. 43-48
6 p.
|
artikel
|
| 6 |
A theoretical investigation on fullerene-like phosphorus clusters
|
Han, Ju-Guang
|
|
2004
|
396 |
1-3 |
p. 27-33
7 p.
|
artikel
|
| 7 |
Bending vibration of platinum monocarbonyl PtCO: observation of the millimeter- and submillimeter-wave spectra in the ν2 excited vibrational state
|
Yamazaki, Emi
|
|
2004
|
396 |
1-3 |
p. 150-154
5 p.
|
artikel
|
| 8 |
Catalyst-free growth of carbon nanotubes by laser-annealing of amorphous SiC films
|
Botti, S.
|
|
2004
|
396 |
1-3 |
p. 1-5
5 p.
|
artikel
|
| 9 |
Chemisorption of atomic and molecular oxygen on Au and Ag cluster anions: discrimination of different isomers
|
Kim, Y.D.
|
|
2004
|
396 |
1-3 |
p. 69-74
6 p.
|
artikel
|
| 10 |
Density functional study of onion-skin-like [As@Ni12As20]3− and [Sb@Pd12Sb20]3− cluster ions
|
Zhao, Jijun
|
|
2004
|
396 |
1-3 |
p. 161-166
6 p.
|
artikel
|
| 11 |
Direct ab initio molecular dynamics study of CH 3 + + Benzene
|
Ishikawa, Yasuyuki
|
|
2004
|
396 |
1-3 |
p. 16-20
5 p.
|
artikel
|
| 12 |
Editorial board
|
|
|
2004
|
396 |
1-3 |
p. IFC-
1 p.
|
artikel
|
| 13 |
Effect of geometry on the time law of Liesegang patterning
|
Lagzi, István
|
|
2004
|
396 |
1-3 |
p. 97-101
5 p.
|
artikel
|
| 14 |
Effects of protonation on the dipole polarizability of monocyclic azines: a theoretical study
|
Soscún, Humberto
|
|
2004
|
396 |
1-3 |
p. 117-121
5 p.
|
artikel
|
| 15 |
Efficient encapsulation of gaseous nitrogen inside carbon nanotubes with bamboo-like structure using aerosol thermolysis
|
Reyes-Reyes, M.
|
|
2004
|
396 |
1-3 |
p. 167-173
7 p.
|
artikel
|
| 16 |
Electrical properties in disk-like phenylene derivative in crystalline state
|
Sugita, Atsushi
|
|
2004
|
396 |
1-3 |
p. 131-135
5 p.
|
artikel
|
| 17 |
Electronegativity and charge-injection barrier at organic/metal interfaces
|
Tang, J.X.
|
|
2004
|
396 |
1-3 |
p. 92-96
5 p.
|
artikel
|
| 18 |
Electron emission from individual nitrogen-doped multi-walled carbon nanotubes
|
Doytcheva, Maya
|
|
2004
|
396 |
1-3 |
p. 126-130
5 p.
|
artikel
|
| 19 |
Formation of [C5H6(NH3)2]+ and [NH4(NH3) m ]+ (m =1–3) from size-selected aniline–ammonia cluster cations in intense laser fields
|
Itakura, Ryuji
|
|
2004
|
396 |
1-3 |
p. 208-212
5 p.
|
artikel
|
| 20 |
Growth of aligned ZnO nanorod arrays by catalyst-free pulsed laser deposition methods
|
Sun, Ye
|
|
2004
|
396 |
1-3 |
p. 21-26
6 p.
|
artikel
|
| 21 |
High-resolution Fourier-transform intra-cavity laser absorption study of H12C13CH and H13C13CH at around 12600 cm−1: a case of strong anharmonic resonances
|
Yang, Shengfu
|
|
2004
|
396 |
1-3 |
p. 213-218
6 p.
|
artikel
|
| 22 |
Ipsocentric and allocentric methods of mapping induced current density
|
Soncini, A
|
|
2004
|
396 |
1-3 |
p. 174-181
8 p.
|
artikel
|
| 23 |
Laser field designing by evolutionary algorithm for coherent control of molecular dynamics
|
Sugawara, M.
|
|
2004
|
396 |
1-3 |
p. 136-141
6 p.
|
artikel
|
| 24 |
Modification of microcantilevers using layer-by-layer nanoassembly film for glucose measurement
|
Yan, Xiaodong
|
|
2004
|
396 |
1-3 |
p. 34-37
4 p.
|
artikel
|
| 25 |
New basis sets for xenon and the interaction polarizability of two xenon atoms
|
Maroulis, George
|
|
2004
|
396 |
1-3 |
p. 59-65
7 p.
|
artikel
|
| 26 |
Optically switchable behaviour of a dioxolene adduct of a cobalt-macrocycle complex
|
Carbonera, Chiara
|
|
2004
|
396 |
1-3 |
p. 198-201
4 p.
|
artikel
|
| 27 |
Photoinduced proton transfer from the green fluorescent protein chromophore to a water molecule: analysis of the transfer coordinate
|
Vendrell, Oriol
|
|
2004
|
396 |
1-3 |
p. 202-207
6 p.
|
artikel
|
| 28 |
Picosecond dynamics in water-soluble azobenzene-peptides
|
Satzger, H.
|
|
2004
|
396 |
1-3 |
p. 191-197
7 p.
|
artikel
|
| 29 |
Reaction mechanism of hydrogenation of carbon dioxide to formic acid in the presence of scandium oxide: a density functional study
|
Hwang, Der-Yan
|
|
2004
|
396 |
1-3 |
p. 75-82
8 p.
|
artikel
|
| 30 |
Reactive and non-reactive vibrational quenching in O+OH collisions
|
Varandas, A.J.C.
|
|
2004
|
396 |
1-3 |
p. 182-190
9 p.
|
artikel
|
| 31 |
Realization of the new summing algorithm on an NMR ensemble quantum computer
|
Wei, Daxiu
|
|
2004
|
396 |
1-3 |
p. 122-125
4 p.
|
artikel
|
| 32 |
Spectroscopic studies on the excited-state properties of the light-induced antiviral drug hypocrellin A loaded in the mesoporous solid
|
Zhang, Lei Z.
|
|
2004
|
396 |
1-3 |
p. 102-109
8 p.
|
artikel
|
| 33 |
Surface characterisation of template-synthesised multi-walled carbon nanotubes
|
Babaa, M.-R.
|
|
2004
|
396 |
1-3 |
p. 49-53
5 p.
|
artikel
|
| 34 |
Surface energetics of hydroxyapatite: a DFT study
|
Zhu, Weihua
|
|
2004
|
396 |
1-3 |
p. 38-42
5 p.
|
artikel
|
| 35 |
Synthesis of hybrid multiwall carbon nanotubes and their enhanced field emission properties
|
Kim, Ha Jin
|
|
2004
|
396 |
1-3 |
p. 6-9
4 p.
|
artikel
|
| 36 |
The probe dependence of solvation dynamics and rotation in the ionic liquid 1-butyl-3-methyl-imidazolium hexafluorophosphate
|
Ito, N.
|
|
2004
|
396 |
1-3 |
p. 83-91
9 p.
|
artikel
|
| 37 |
Time-domain analysis of electronic spectra in superfluid 4He
|
Eloranta, J.
|
|
2004
|
396 |
1-3 |
p. 155-160
6 p.
|
artikel
|
| 38 |
Voltage color tunable OLED with (Sm,Eu)-β-diketonate complex blend
|
Reyes, R.
|
|
2004
|
396 |
1-3 |
p. 54-58
5 p.
|
artikel
|
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