| nr |
titel |
auteur |
tijdschrift |
jaar |
jaarg. |
afl. |
pagina('s) |
type |
| 1 |
A computational study of the charge-delocalized and charge-localized forms of the croconate and rhodizonate dianions
|
Cheng, Mei-Fun
|
|
2004
|
391 |
1-3 |
p. 157-164
8 p.
|
artikel
|
| 2 |
Activated and intermittent photoluminescence in thin CdSe quantum dot films
|
Javier, Artjay
|
|
2004
|
391 |
1-3 |
p. 60-63
4 p.
|
artikel
|
| 3 |
A density functional study of some silver cluster hydrides
|
Lins, João Otávio M.A.
|
|
2004
|
391 |
1-3 |
p. 9-15
7 p.
|
artikel
|
| 4 |
An ab initio study on the mechanism of the F+O3 →FO+O2 reaction: comparative reactivity study along the isoelectronic NH2, OH and F radicals series
|
Peiró-Garcı́a, Julio
|
|
2004
|
391 |
1-3 |
p. 195-199
5 p.
|
artikel
|
| 5 |
Are hydrogen bonds to sulfur and oxygen different? Theoretical study of dimethylsulfide and dimethylether complexes with nitric acid
|
Wierzejewska, Maria
|
|
2004
|
391 |
1-3 |
p. 143-147
5 p.
|
artikel
|
| 6 |
A study of hydrogen bond of imidazole and its 4-nitro derivative by ab initio and DFT calculated NQR parameters
|
Amini, S.K.
|
|
2004
|
391 |
1-3 |
p. 95-100
6 p.
|
artikel
|
| 7 |
Atmospheric chemistry of CH3CHF2 (R-152a): mechanism of the CH3CF2O2 +HO2 reaction
|
Hashikawa, Y.
|
|
2004
|
391 |
1-3 |
p. 165-169
5 p.
|
artikel
|
| 8 |
Chromophore vibrations during isomerization of photoactive yellow protein: analysis of normal modes and energy transfer
|
Yu, Xin
|
|
2004
|
391 |
1-3 |
p. 181-186
6 p.
|
artikel
|
| 9 |
Combination of carbon nanotubes and two-photon absorbers for broadband optical limiting
|
Izard, N.
|
|
2004
|
391 |
1-3 |
p. 124-128
5 p.
|
artikel
|
| 10 |
Combination of the exact potential and multipole methods (EP/MM) for evaluation of intermolecular electrostatic interaction energies with pseudoatom representation of molecular electron densities
|
Volkov, Anatoliy
|
|
2004
|
391 |
1-3 |
p. 170-175
6 p.
|
artikel
|
| 11 |
Diffusion of rubidium atoms in PDMS thin films
|
Kasprowicz, M.J.
|
|
2004
|
391 |
1-3 |
p. 191-194
4 p.
|
artikel
|
| 12 |
Editorial board
|
|
|
2004
|
391 |
1-3 |
p. IFC-
1 p.
|
artikel
|
| 13 |
Effect of local feedback on Turing pattern formation
|
Ji, Lin
|
|
2004
|
391 |
1-3 |
p. 176-180
5 p.
|
artikel
|
| 14 |
Endohedral confinement of molecular hydrogen
|
Soullard, Jacques
|
|
2004
|
391 |
1-3 |
p. 187-190
4 p.
|
artikel
|
| 15 |
Endothermic exciplex–exciton energy-transfer in a blue-emitting polymeric heterojunction system
|
Morteani, Arne C.
|
|
2004
|
391 |
1-3 |
p. 81-84
4 p.
|
artikel
|
| 16 |
Erratum to: `Order–disorder transitions and melting in a helical polymer crystal: molecular dynamics calculations of model poly(ethylene oxide)' [Chem. Phys. Lett. 385 (2004) 351–356]
|
Krishnan, M
|
|
2004
|
391 |
1-3 |
p. 200-
1 p.
|
artikel
|
| 17 |
Evidence for a photophysical deactivation pathway competing with the photochromic transformation in a cyano-substituted spironaphthoxazine
|
Buntinx, Guy
|
|
2004
|
391 |
1-3 |
p. 33-37
5 p.
|
artikel
|
| 18 |
Group theoretical analysis of vibrational modes and rovibronic levels of extended aromatic C48N12 azafullerene
|
Balasubramanian, Krishnan
|
|
2004
|
391 |
1-3 |
p. 64-68
5 p.
|
artikel
|
| 19 |
High resolution IR-diode laser jet spectroscopy of malonaldehyde
|
Duan, Chuanxi
|
|
2004
|
391 |
1-3 |
p. 129-133
5 p.
|
artikel
|
| 20 |
Hydrogen-atom inversion of 1,2-dimethylhydrazine in low-temperature rare-gas matrices
|
Ichimura, Koji
|
|
2004
|
391 |
1-3 |
p. 50-55
6 p.
|
artikel
|
| 21 |
Hydrogen-bonding between the hydrogen peroxide molecule and the hydroperoxy radical (H2O2–HO2): the global minimum
|
Alikhani, Mohammad Esmaı̈l
|
|
2004
|
391 |
1-3 |
p. 134-137
4 p.
|
artikel
|
| 22 |
Infrared photodissociation spectra and solvation structures of Mg+(CH3OH) n (n=1–4)
|
Machinaga, Hironobu
|
|
2004
|
391 |
1-3 |
p. 85-90
6 p.
|
artikel
|
| 23 |
Laser-controlled dissolution of gold nanoparticles in glass
|
Jiang, Xiongwei
|
|
2004
|
391 |
1-3 |
p. 91-94
4 p.
|
artikel
|
| 24 |
Long range superhyperfine interactions in polycrystalline vanadium doped SnO2 investigated by CW and pulsed ENDOR spectroscopy
|
Murphy, Damien M.
|
|
2004
|
391 |
1-3 |
p. 1-8
8 p.
|
artikel
|
| 25 |
Modeling of FS 2+ center at the magnesium oxide (100) hydrated surface
|
Ménétrey, M.
|
|
2004
|
391 |
1-3 |
p. 120-123
4 p.
|
artikel
|
| 26 |
Nuclear spin statistics of extended aromatic C48N12 azafullerene
|
Balasubramanian, K
|
|
2004
|
391 |
1-3 |
p. 69-74
6 p.
|
artikel
|
| 27 |
On the electron affinity of TCNQ
|
Milián, Begoña
|
|
2004
|
391 |
1-3 |
p. 148-151
4 p.
|
artikel
|
| 28 |
Potential energy surface and intermolecular vibrations of O2–H2O
|
Sabu, Akiyoshi
|
|
2004
|
391 |
1-3 |
p. 101-105
5 p.
|
artikel
|
| 29 |
Pressure effects on the electronic and structural properties of molecules
|
Cruz, Salvador A
|
|
2004
|
391 |
1-3 |
p. 138-142
5 p.
|
artikel
|
| 30 |
Sensitive fluorescence spectroscopy of jet cooled 15NO2
|
Volkers, E.A
|
|
2004
|
391 |
1-3 |
p. 106-111
6 p.
|
artikel
|
| 31 |
Spontaneous decrease of high surface electrical conductivity in diamond exposed to atmospheric air
|
Kulesza, Sławomir
|
|
2004
|
391 |
1-3 |
p. 56-59
4 p.
|
artikel
|
| 32 |
The hyperpolarizability of the Ne atom in the approximate coupled cluster triples model CC3
|
Pawłowski, Filip
|
|
2004
|
391 |
1-3 |
p. 27-32
6 p.
|
artikel
|
| 33 |
The micro-solvation of Na+: theoretical study of bonding characteristics in weakly bonded Ar n Na+ (n=1–8) clusters
|
Giju, Kalathingal T.
|
|
2004
|
391 |
1-3 |
p. 112-119
8 p.
|
artikel
|
| 34 |
Theoretical study of the OH addition to the β-pinene
|
Ramı́rez-Ramı́rez, Vı́ctor M.
|
|
2004
|
391 |
1-3 |
p. 152-156
5 p.
|
artikel
|
| 35 |
The permanent electric dipole moments of ruthenium monocarbide in the 3 Π and 3 Δ states
|
Virgo, Wilton L.
|
|
2004
|
391 |
1-3 |
p. 75-80
6 p.
|
artikel
|
| 36 |
Three-photon absorption enhancement in a symmetrical charge transfer fluorene derivative
|
Hernández, Florencio E
|
|
2004
|
391 |
1-3 |
p. 22-26
5 p.
|
artikel
|
| 37 |
Tryptophan photoionization from prefluorescent and fluorescent states
|
Sherin, Peter S
|
|
2004
|
391 |
1-3 |
p. 44-49
6 p.
|
artikel
|
| 38 |
Two-color two-photon REMPI and ZEKE photoelectron spectroscopy of jet-cooled 2-chloropyrimidine
|
He, Yonggang
|
|
2004
|
391 |
1-3 |
p. 38-43
6 p.
|
artikel
|
| 39 |
Unrestricted open-shell Kohn–Sham scheme with local hybrid exchange-correlation potentials: improved calculation of electronic g-tensors for transition-metal complexes
|
Arbuznikov, Alexei V
|
|
2004
|
391 |
1-3 |
p. 16-21
6 p.
|
artikel
|
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