nr |
titel |
auteur |
tijdschrift |
jaar |
jaarg. |
afl. |
pagina('s) |
type |
1 |
Ab-initio calculation of the ground and excited states of MgH using a pseudopotential approach
|
Mestdagh, J.-M. |
|
2009 |
471 |
1-3 |
p. 22-28 7 p. |
artikel |
2 |
Analysing the chromium–chromium multiple bonds using multiconfigurational quantum chemistry
|
Brynda, Marcin |
|
2009 |
471 |
1-3 |
p. 1-10 10 p. |
artikel |
3 |
An effective sonication-assisted reduction approach to synthesize highly dispersed Co nanoparticles on SiO2
|
Lim, Wallace Tse Loong |
|
2009 |
471 |
1-3 |
p. 122-127 6 p. |
artikel |
4 |
A new ab initio potential energy surface for the Ne–H2 interaction
|
Lique, François |
|
2009 |
471 |
1-3 |
p. 54-58 5 p. |
artikel |
5 |
Bond metallicity of materials from real space charge density distributions
|
Jenkins, S. |
|
2009 |
471 |
1-3 |
p. 174-177 4 p. |
artikel |
6 |
Broadband dielectric response of dichloromethane
|
Hunger, Johannes |
|
2009 |
471 |
1-3 |
p. 85-91 7 p. |
artikel |
7 |
Carbohydrate–aromatic interactions: A computational and IR spectroscopic investigation of the complex, methyl α-l-fucopyranoside·toluene, isolated in the gas phase
|
Su, Zheng |
|
2009 |
471 |
1-3 |
p. 17-21 5 p. |
artikel |
8 |
Characterization of local structures in amorphous and crystalline tris(8-hydroxyquinoline) aluminum(III) (Alq3) by solid-state 27Al MQMAS NMR spectroscopy
|
Nishiyama, Yusuke |
|
2009 |
471 |
1-3 |
p. 80-84 5 p. |
artikel |
9 |
Contents
|
|
|
2009 |
471 |
1-3 |
p. iii-xi nvt p. |
artikel |
10 |
DFT calculation of pKa’s for dimethoxypyrimidinylsalicylic based herbicides
|
Delgado, Eduardo J. |
|
2009 |
471 |
1-3 |
p. 133-135 3 p. |
artikel |
11 |
Editorial Board
|
|
|
2009 |
471 |
1-3 |
p. IFC- 1 p. |
artikel |
12 |
Effect of the vibrational excitation on the non-radiative deactivation rate of the S1 state of p-cresol(NH3) complex
|
Oldani, A.N. |
|
2009 |
471 |
1-3 |
p. 41-44 4 p. |
artikel |
13 |
Electrophilicity of quinones and its relationship with hydride affinity
|
Campodónico, Paola R. |
|
2009 |
471 |
1-3 |
p. 168-173 6 p. |
artikel |
14 |
Evaluation of instrument response functions for lifetime imaging detectors using quenched Rose Bengal solutions
|
Szabelski, Mariusz |
|
2009 |
471 |
1-3 |
p. 153-159 7 p. |
artikel |
15 |
Excitation spectra of CdRg (Rg=He, Ne, Xe) complexes recorded at the D 1 Σ 0 + ← X 1 Σ 0 + transition: From the heaviest CdXe to the lightest CdHe
|
Strojecki, M. |
|
2009 |
471 |
1-3 |
p. 29-35 7 p. |
artikel |
16 |
First principle simulation of vibrationally resolved A 2 B 1 ← X ˜ 2 A 1 electronic transition of phenyl radical
|
Biczysko, Malgorzata |
|
2009 |
471 |
1-3 |
p. 143-147 5 p. |
artikel |
17 |
Frequency-controllable electric field distribution in colloidal crystals
|
Zhang, L.F. |
|
2009 |
471 |
1-3 |
p. 106-110 5 p. |
artikel |
18 |
Heterofullerene molecules C58X (X=S,Se,Te): A DFT study
|
Liu, Feng-Ling |
|
2009 |
471 |
1-3 |
p. 116-121 6 p. |
artikel |
19 |
Highly aligned carbon nanotube/polymer composites with much improved electrical conductivities
|
Peng, Huisheng |
|
2009 |
471 |
1-3 |
p. 103-105 3 p. |
artikel |
20 |
Hydrogen bonding interaction in complexes of hydronium ion with selective chemical species
|
Joshi, Ravi |
|
2009 |
471 |
1-3 |
p. 36-40 5 p. |
artikel |
21 |
Influence of protonation upon the conformations of bipiperidine, bimorpholine, and their derivatives
|
Uudsemaa, Merle |
|
2009 |
471 |
1-3 |
p. 92-96 5 p. |
artikel |
22 |
Infrared spectroscopy for acetone and its dimer based on photoionization detection with tunable coherent vacuum-ultraviolet light
|
Matsuda, Yoshiyuki |
|
2009 |
471 |
1-3 |
p. 50-53 4 p. |
artikel |
23 |
In situ growth of SnO2 nanowires on the surface of Au-coated Sn grains using water-assisted chemical vapor deposition
|
Yin, Wenyan |
|
2009 |
471 |
1-3 |
p. 11-16 6 p. |
artikel |
24 |
Interaction and photobinding between 8-methoxypsoralen and thymine
|
Omar, Salama |
|
2009 |
471 |
1-3 |
p. 128-132 5 p. |
artikel |
25 |
Is the LEPS potential accurate enough to investigate the dissociation of diatomic molecules on surfaces?
|
Martin-Gondre, L. |
|
2009 |
471 |
1-3 |
p. 136-142 7 p. |
artikel |
26 |
Modelling the polarizability of the dihydrogen–argon pair
|
Bancewicz, Tadeusz |
|
2009 |
471 |
1-3 |
p. 148-152 5 p. |
artikel |
27 |
Observation of collision-induced near-IR emission of singlet oxygen O2 a1Δg generated by visible light excitation of gaseous O2 dimol
|
Furui, Eiji |
|
2009 |
471 |
1-3 |
p. 45-49 5 p. |
artikel |
28 |
Polaron transport between DNA segments: annihilating and creating
|
Zhang, Guiqing |
|
2009 |
471 |
1-3 |
p. 163-167 5 p. |
artikel |
29 |
Quasi-classical determination of integral cross-sections and rate constants for the N + OH → NO + H reaction
|
Jorfi, M. |
|
2009 |
471 |
1-3 |
p. 65-70 6 p. |
artikel |
30 |
Quasi-classical trajectory study of the reaction H+FO→OH+F
|
Zhao, Juan |
|
2009 |
471 |
1-3 |
p. 160-162 3 p. |
artikel |
31 |
Reorientation of HDO in liquid H2O at different temperatures: Comparison of first and second order correlation functions
|
Tielrooij, K.J. |
|
2009 |
471 |
1-3 |
p. 71-74 4 p. |
artikel |
32 |
Selective interaction of a soluble pentacene derivative with metallic single-walled carbon nanotubes
|
Liu, Cai-Hong |
|
2009 |
471 |
1-3 |
p. 97-102 6 p. |
artikel |
33 |
State-to-state quasi-classical trajectory study of the F+CH2D2 reaction
|
Espinosa-García, Joaquín |
|
2009 |
471 |
1-3 |
p. 59-64 6 p. |
artikel |
34 |
Theoretical investigation on the polarizability and second hyperpolarizability of polysilole
|
Champagne, Benoît |
|
2009 |
471 |
1-3 |
p. 111-115 5 p. |
artikel |
35 |
Ti 3p electrons: Core or valence?
|
Aaron Deskins, N. |
|
2009 |
471 |
1-3 |
p. 75-79 5 p. |
artikel |