| nr |
titel |
auteur |
tijdschrift |
jaar |
jaarg. |
afl. |
pagina('s) |
type |
| 1 |
A density functional theory study applied for carbon isotope effects in the non-aqueous [Cu(CO)]+/CO system
|
Ono, Yuriko
|
|
2004
|
390 |
1-3 |
p. 71-78
8 p.
|
artikel
|
| 2 |
A generalized exchange-correlation functional: the Neural-Networks approach
|
Zheng, Xiao
|
|
2004
|
390 |
1-3 |
p. 186-192
7 p.
|
artikel
|
| 3 |
An electron momentum spectroscopy study of the highest occupied molecular orbital of difluoromethane
|
Su, G.L.
|
|
2004
|
390 |
1-3 |
p. 162-165
4 p.
|
artikel
|
| 4 |
Anomalous change in interfacial tension induced by collapses of AOT microemulsions at heptane/water interface
|
Takahashi, Masahiko
|
|
2004
|
390 |
1-3 |
p. 104-109
6 p.
|
artikel
|
| 5 |
A robust pulse sequence for the determination of small homonuclear dipolar couplings in magic-angle spinning NMR
|
Kristiansen, Per Eugen
|
|
2004
|
390 |
1-3 |
p. 1-7
7 p.
|
artikel
|
| 6 |
A study on stabilization of HHeF molecule upon complexation with Xe atoms
|
Lignell, Antti
|
|
2004
|
390 |
1-3 |
p. 256-260
5 p.
|
artikel
|
| 7 |
Au-nano-particles production by pico-second ultra-violet laser deposition in Au-ion doped PMMA film
|
Hirose, Tomohiro
|
|
2004
|
390 |
1-3 |
p. 166-169
4 p.
|
artikel
|
| 8 |
Calculating electron transfer couplings by the Spin-Flip approach: energy splitting and dynamical correlation effects
|
You, Zhi-Qiang
|
|
2004
|
390 |
1-3 |
p. 116-123
8 p.
|
artikel
|
| 9 |
Calculation of the electronic spectra of molecules in solution and on surfaces
|
Besley, Nicholas A.
|
|
2004
|
390 |
1-3 |
p. 124-129
6 p.
|
artikel
|
| 10 |
Cavity-enhanced absorption spectroscopy with a mode-locked diode-pumped vertical external-cavity surface-emitting laser
|
Gherman, T.
|
|
2004
|
390 |
1-3 |
p. 290-295
6 p.
|
artikel
|
| 11 |
Charge order, orbital order, and electron localization in the Magnéli phase Ti4O7
|
Eyert, V.
|
|
2004
|
390 |
1-3 |
p. 151-156
6 p.
|
artikel
|
| 12 |
Comment on `Modelling pattern formation in CO+O2 (reaction) on Pt{100}'
|
Zhdanov, Vladimir P.
|
|
2004
|
390 |
1-3 |
p. 301-304
4 p.
|
artikel
|
| 13 |
Current–voltage curves for molecular junctions: pyrene vs diphenylacetylene
|
Bauschlicher Jr., Charles W.
|
|
2004
|
390 |
1-3 |
p. 246-249
4 p.
|
artikel
|
| 14 |
Density functional study of cucurbituril and its sulfur analogue
|
Pichierri, Fabio
|
|
2004
|
390 |
1-3 |
p. 214-219
6 p.
|
artikel
|
| 15 |
Dielectric susceptibility of dipolar molecular liquids by ab initio molecular dynamics: application to liquid HCl
|
Dubois, Vincent
|
|
2004
|
390 |
1-3 |
p. 193-198
6 p.
|
artikel
|
| 16 |
Disappearing of the Verwey transition in magnetite nanoparticles synthesized under a magnetic field: implications for the origin of charge ordering
|
Wang, Jun
|
|
2004
|
390 |
1-3 |
p. 55-58
4 p.
|
artikel
|
| 17 |
Dynamics of a highly branched lipid bilayer: a molecular dynamics study
|
Shinoda, Wataru
|
|
2004
|
390 |
1-3 |
p. 35-40
6 p.
|
artikel
|
| 18 |
Dynamics of vibronically excited states of the aniline–neon van der Waals complex: vibrational predissociation versus intramolecular vibrational redistribution
|
Becucci, M.
|
|
2004
|
390 |
1-3 |
p. 29-34
6 p.
|
artikel
|
| 19 |
Editorial board
|
|
|
2004
|
390 |
1-3 |
p. IFC-
1 p.
|
artikel
|
| 20 |
Electronic structure near the Fermi level of the organic semiconductor copper phthalocyanine
|
Downes, James E.
|
|
2004
|
390 |
1-3 |
p. 203-207
5 p.
|
artikel
|
| 21 |
Electro-optic characterization of two novel organic materials in thin polymeric films
|
Anestopoulos, D.
|
|
2004
|
390 |
1-3 |
p. 98-103
6 p.
|
artikel
|
| 22 |
Exact statistical mechanical treatment of a toroidal lattice model of narrow-bore nanotube alkane adsorption isotherms and comparison with Monte-Carlo simulations
|
Dunne, Lawrence J.
|
|
2004
|
390 |
1-3 |
p. 14-19
6 p.
|
artikel
|
| 23 |
Experimental and theoretical study of the vibrational spectrum, structure and electron density distribution of the [2-CB10H11]− anion
|
Kononova, E.G.
|
|
2004
|
390 |
1-3 |
p. 279-284
6 p.
|
artikel
|
| 24 |
Gas phase aggregates of protected clusters
|
Cyriac, Jobin
|
|
2004
|
390 |
1-3 |
p. 181-185
5 p.
|
artikel
|
| 25 |
High-intensity and ground-state influence on photoassociation line shapes of 88Sr
|
Ribeiro, E.M.S.
|
|
2004
|
390 |
1-3 |
p. 89-93
5 p.
|
artikel
|
| 26 |
Homogeneous-catalytic synthesis of tetrapodlike ZnO nanocrystals and their photoluminescence properties
|
Yu, W.D.
|
|
2004
|
390 |
1-3 |
p. 296-300
5 p.
|
artikel
|
| 27 |
Identification of tetrahedrally ordered Si–O–Al environments in molecular sieves by {27Al}–29Si REAPDOR NMR
|
Ganapathy, S.
|
|
2004
|
390 |
1-3 |
p. 79-83
5 p.
|
artikel
|
| 28 |
Intermolecular transfer integrals for organic molecular materials: can basis set convergence be achieved?
|
Huang, Jingsong
|
|
2004
|
390 |
1-3 |
p. 110-115
6 p.
|
artikel
|
| 29 |
Kinetics of salt-induced J-aggregation of an anionic thiacarbocyanine dye in aqueous solution
|
Chibisov, Alexander K.
|
|
2004
|
390 |
1-3 |
p. 240-245
6 p.
|
artikel
|
| 30 |
Kinetic studies of differences between α- and β-chains of human hemoglobin: an approach for determination of the chain affinity to oxygen
|
Dzhagarov, B.M.
|
|
2004
|
390 |
1-3 |
p. 59-64
6 p.
|
artikel
|
| 31 |
Laser-driven coherent manipulation of molecular chirality
|
Thanopulos, I.
|
|
2004
|
390 |
1-3 |
p. 228-235
8 p.
|
artikel
|
| 32 |
Magneto-dynamics of chiral carbon nanotubes
|
Krstić, V.
|
|
2004
|
390 |
1-3 |
p. 25-28
4 p.
|
artikel
|
| 33 |
Mass analyzed threshold ionization spectroscopy of p-fluorophenol cation and the p-fluoro substitution effect
|
Zhang, Bing
|
|
2004
|
390 |
1-3 |
p. 65-70
6 p.
|
artikel
|
| 34 |
Neutron diffraction evidence of double interaction between NaY zeolite and ammonia and migration of Na+ ions upon ND3 adsorption
|
Gilles, F.
|
|
2004
|
390 |
1-3 |
p. 236-239
4 p.
|
artikel
|
| 35 |
Observation of an optically forbidden state of C60 by nondegenerate two-photon absorption spectroscopy
|
Yamaguchi, Shoichi
|
|
2004
|
390 |
1-3 |
p. 136-139
4 p.
|
artikel
|
| 36 |
Photoionization of NO(A 2 Σ + , v=0,N) at 226 nm: ion-recoil momentum spectroscopy
|
Chichinin, Alexei I.
|
|
2004
|
390 |
1-3 |
p. 50-54
5 p.
|
artikel
|
| 37 |
Polarizabilities of small annulenes from Cholesky CC2 linear response theory
|
Garcı́a Cuesta, I.
|
|
2004
|
390 |
1-3 |
p. 170-175
6 p.
|
artikel
|
| 38 |
Pronounced out-of-plane diffraction of H2 molecules from a Pd(111) surface
|
Farı́as, D.
|
|
2004
|
390 |
1-3 |
p. 250-255
6 p.
|
artikel
|
| 39 |
Reply to `Comment on `Modelling pattern formation in CO+O2 on Pt{100}”
|
Irurzun, I.M.
|
|
2004
|
390 |
1-3 |
p. 305-306
2 p.
|
artikel
|
| 40 |
Reversibly strain-tunable elastomeric photonic crystals
|
Li, Jian
|
|
2004
|
390 |
1-3 |
p. 285-289
5 p.
|
artikel
|
| 41 |
Solvent effect on the electrochemical reductive cleavage of carbon tetrachloride – a novel example of the deviation from the quadratic activation-driving force relationship
|
Prasad, M.Arun
|
|
2004
|
390 |
1-3 |
p. 261-267
7 p.
|
artikel
|
| 42 |
Spectral broadening in a microdroplet dye laser
|
Knospe, Anders G.
|
|
2004
|
390 |
1-3 |
p. 130-135
6 p.
|
artikel
|
| 43 |
Structures and stabilities of B7, B7 + and B7 − clusters
|
Li, Qian-Shu
|
|
2004
|
390 |
1-3 |
p. 220-227
8 p.
|
artikel
|
| 44 |
Structures of [Mg·(H2O)1,2]+ and [Al·(H2O)1,2]+ ions studied by infrared photodissociation spectroscopy: evidence of [HO–Al–H]+ ion core structure in [Al·(H2O)2]+
|
Inokuchi, Yoshiya
|
|
2004
|
390 |
1-3 |
p. 140-144
5 p.
|
artikel
|
| 45 |
Study on optimization of molecular structure using Hamiltonian algorithm
|
Ohtawara, Kazushige
|
|
2004
|
390 |
1-3 |
p. 84-88
5 p.
|
artikel
|
| 46 |
Study on the structure and intra- and intermolecular hydrogen bonding of 2-methoxyphenol·(H2O) n (n=1,2)
|
Wu, Ronghu
|
|
2004
|
390 |
1-3 |
p. 272-278
7 p.
|
artikel
|
| 47 |
The general failure of Kleinman symmetry in practical nonlinear optical applications
|
Dailey, Christopher A.
|
|
2004
|
390 |
1-3 |
p. 8-13
6 p.
|
artikel
|
| 48 |
The isomerization of [H2O–CO] + and [HC(O)OH] + into [HO–C–OH] +: proton-transport catalysis by CO
|
Wong, Cathy Y.
|
|
2004
|
390 |
1-3 |
p. 176-180
5 p.
|
artikel
|
| 49 |
Time and kinetic energy resolved delayed electron emission in small carbon cluster anions
|
Wills, J.B.
|
|
2004
|
390 |
1-3 |
p. 145-150
6 p.
|
artikel
|
| 50 |
Time dependent evolution of vanadium pentoxide nanowires in sols
|
Park, Sung Joon
|
|
2004
|
390 |
1-3 |
p. 199-202
4 p.
|
artikel
|
| 51 |
Topology of the hydrogen bond networks in liquid water at room and supercritical conditions: a small-world structure
|
Marques Leite dos Santos, Vivianni
|
|
2004
|
390 |
1-3 |
p. 157-161
5 p.
|
artikel
|
| 52 |
Two-photon spectroscopic properties of a new chlorin derivative photosensitizer
|
Zhao, P.D.
|
|
2004
|
390 |
1-3 |
p. 41-44
4 p.
|
artikel
|
| 53 |
Ultrafast excitation relaxation dynamics and energy transfer in the siphonaxanthin-containing green alga Codium fragile
|
Akimoto, Seiji
|
|
2004
|
390 |
1-3 |
p. 45-49
5 p.
|
artikel
|
| 54 |
Understanding proton magnetic shielding in the benzene molecule
|
Ferraro, M.B.
|
|
2004
|
390 |
1-3 |
p. 268-271
4 p.
|
artikel
|
| 55 |
Using terahertz pulsed spectroscopy to study crystallinity of pharmaceutical materials
|
Strachan, Clare J.
|
|
2004
|
390 |
1-3 |
p. 20-24
5 p.
|
artikel
|
| 56 |
Vibrationally resolved in situ XPS study of activated adsorption of methane on Pt(111)
|
Fuhrmann, T.
|
|
2004
|
390 |
1-3 |
p. 208-213
6 p.
|
artikel
|
| 57 |
When molecules meet: a femtosecond study of the protonation of a base
|
Keiding, Søren Rud
|
|
2004
|
390 |
1-3 |
p. 94-97
4 p.
|
artikel
|
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