| nr |
titel |
auteur |
tijdschrift |
jaar |
jaarg. |
afl. |
pagina('s) |
type |
| 1 |
Ab initio centroid molecular dynamics: a fully quantum method for condensed-phase dynamics simulations
|
Pavese, Marc
|
|
1999
|
300 |
1-2 |
p. 93-98
|
artikel
|
| 2 |
Ab initio determinations of magnetic circular dichroism
|
Coriani, Sonia
|
|
1999
|
300 |
1-2 |
p. 61-68
|
artikel
|
| 3 |
Ab initio study of the lowest 3 Σ − , 3 Π and 1 Σ + states of the SiN+ cation
|
Cai, Z.-L
|
|
1999
|
300 |
1-2 |
p. 69-79
|
artikel
|
| 4 |
Accurate D 0 value for NF+
|
Ricca, Alessandra
|
|
1999
|
300 |
1-2 |
p. 80-84
|
artikel
|
| 5 |
A coupled-cluster correction to the multi-reference configuration interaction method
|
Meissner, Leszek
|
|
1999
|
300 |
1-2 |
p. 53-60
|
artikel
|
| 6 |
A fully geometrical analysis of indirect reactive scattering
|
Wadi, Hicham
|
|
1999
|
300 |
1-2 |
p. 37-43
|
artikel
|
| 7 |
Application of the semiclassical initial value representation and its linearized approximation to inelastic scattering
|
Skinner, David E.
|
|
1999
|
300 |
1-2 |
p. 20-26
|
artikel
|
| 8 |
A quantum chemical study of the NO/MgO chemisorption system: hybrid B3LYP calculations on NO/(MgO) n (n=4,6,8) model systems
|
Lu, Xin
|
|
1999
|
300 |
1-2 |
p. 109-117
|
artikel
|
| 9 |
Density functional theory calculations for F−
|
Jaręcki, Andrzej A.
|
|
1999
|
300 |
1-2 |
p. 44-52
|
artikel
|
| 10 |
DFT investigation of the adsorption of atomic hydrogen on a cluster-model graphite surface
|
Jeloaica, L.
|
|
1999
|
300 |
1-2 |
p. 157-162
|
artikel
|
| 11 |
Direct observation of Λ-doublet and hyperfine branching ratios for rotationally inelastic collisions of NO–He at 4.2 K
|
Ball, Christopher D.
|
|
1999
|
300 |
1-2 |
p. 227-235
|
artikel
|
| 12 |
Editorial
|
|
|
1999
|
300 |
1-2 |
p. xi
|
artikel
|
| 13 |
Energy release in benzene–argon cluster dissociation – quasiclassical trajectory calculations
|
Bernshtein, V
|
|
1999
|
300 |
1-2 |
p. 104-108
|
artikel
|
| 14 |
ESR of the P3 − radical: establishment of the electronic ground state
|
Van Zee, R.J.
|
|
1999
|
300 |
1-2 |
p. 243-246
|
artikel
|
| 15 |
Features of the potential energy surface for the decomposition of CH3OF
|
Wang, Baoshan
|
|
1999
|
300 |
1-2 |
p. 99-103
|
artikel
|
| 16 |
Formation enthalpies of Sn clusters: a calorimetric investigation
|
Bachels, T.
|
|
1999
|
300 |
1-2 |
p. 177-182
|
artikel
|
| 17 |
Formation of metallofullerenes with higher group elements
|
Sueki, Keisuke
|
|
1999
|
300 |
1-2 |
p. 140-144
|
artikel
|
| 18 |
Generalized simulated annealing method in the analysis of atom–atom interaction
|
Gutterres, R.F.
|
|
1999
|
300 |
1-2 |
p. 131-139
|
artikel
|
| 19 |
H atom–H2 molecule van der Waals complexes in solid argon matrix by high-resolution ESR spectroscopy
|
Komaguchi, Kenji
|
|
1999
|
300 |
1-2 |
p. 257-261
|
artikel
|
| 20 |
Identification and mobility of deuterated residues in peptides and proteins by 2 H – 13 C solid-state NMR
|
Sandström, Dick
|
|
1999
|
300 |
1-2 |
p. 213-220
|
artikel
|
| 21 |
Identification of singlet and triplet SCNO+ cations in the gas phase: theory and experiment
|
Flammang, Robert
|
|
1999
|
300 |
1-2 |
p. 183-188
|
artikel
|
| 22 |
Imaging individual molecules by two-photon excitation
|
Sonnleitner, M
|
|
1999
|
300 |
1-2 |
p. 221-226
|
artikel
|
| 23 |
Intramolecular hydrogen transfer of excited alkyl radicals in the solid phase
|
Takada, Tomoya
|
|
1999
|
300 |
1-2 |
p. 253-256
|
artikel
|
| 24 |
Linear C11 cluster: an isotopic infrared study
|
Lapinski, Leszek
|
|
1999
|
300 |
1-2 |
p. 195-201
|
artikel
|
| 25 |
Luminescence from V3+ in tetrahedral oxo-coordination
|
Kück, S.
|
|
1999
|
300 |
1-2 |
p. 189-194
|
artikel
|
| 26 |
Molecular property calculations for excited states using a multireference coupled-cluster approach
|
Vaval, Nayana
|
|
1999
|
300 |
1-2 |
p. 125-130
|
artikel
|
| 27 |
Monitoring of H y GaN x and Ga in OMCVD of GaN, using molecular beam quadrupole and REMPI-TOF mass spectrometry
|
Schäfer, Jörg
|
|
1999
|
300 |
1-2 |
p. 152-156
|
artikel
|
| 28 |
Optical excitations in fractal antenna supermolecules with conjugated electrons: extended dendrimers
|
Harigaya, Kikuo
|
|
1999
|
300 |
1-2 |
p. 33-36
|
artikel
|
| 29 |
Orientation of molecules at a liquid surface revealed by ion scattering and recoiling spectroscopy
|
Gannon, Thomas J.
|
|
1999
|
300 |
1-2 |
p. 163-168
|
artikel
|
| 30 |
Photodissociation of ICN in a brute-force field: detection of the ( I ∗ 2 P 1/2 ) product
|
Li, Hongzhi
|
|
1999
|
300 |
1-2 |
p. 247-252
|
artikel
|
| 31 |
Photoinduced intramolecular charge-transfer systems based on porphyrin–viologen dyads for optical limiting
|
Dupuis, Bruno
|
|
1999
|
300 |
1-2 |
p. 169-176
|
artikel
|
| 32 |
Quantum wavepacket calculation for the ion molecule reaction N++H2→NH++H
|
Zhang, Y.C.
|
|
1999
|
300 |
1-2 |
p. 27-32
|
artikel
|
| 33 |
Ring formations from catalytically synthesized carbon nanotubes
|
Ahlskog, M.
|
|
1999
|
300 |
1-2 |
p. 202-206
|
artikel
|
| 34 |
Second-order perturbative approximation to the SAC/SAC-CI method
|
Nakajima, Takahito
|
|
1999
|
300 |
1-2 |
p. 1-8
|
artikel
|
| 35 |
Spin-exchange interactions in the S2-state manganese tetramer in photosynthetic oxygen-evolving complex deduced from g=2 multiline EPR signal
|
Hasegawa, Koji
|
|
1999
|
300 |
1-2 |
p. 9-19
|
artikel
|
| 36 |
Structure of small hydrogenated silicon clusters: global search of low-energy states
|
Meleshko, V.
|
|
1999
|
300 |
1-2 |
p. 118-124
|
artikel
|
| 37 |
Synthesis of single-walled carbon nanotubes using binary (Fe, Co, Ni) alloy nanoparticles prepared in situ by the reduction of oxide solid solutions
|
Flahaut, E.
|
|
1999
|
300 |
1-2 |
p. 236-242
|
artikel
|
| 38 |
The OH production from the π–π* transition of acetylacetone
|
Yoon, Min-Chul
|
|
1999
|
300 |
1-2 |
p. 207-212
|
artikel
|
| 39 |
Theoretical study of the basicity of alkyl amines in vacuo and in different solvents: a density functional theory approach
|
Safi, B.
|
|
1999
|
300 |
1-2 |
p. 85-92
|
artikel
|
| 40 |
The stability of multiply charged vanadium, niobium and tantalum clusters
|
Saito, Naoaki
|
|
1999
|
300 |
1-2 |
p. 262-268
|
artikel
|
| 41 |
Ultraviolet photoelectron spectra of Sc@C82
|
Hino, Shojun
|
|
1999
|
300 |
1-2 |
p. 145-151
|
artikel
|
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