| nr |
titel |
auteur |
tijdschrift |
jaar |
jaarg. |
afl. |
pagina('s) |
type |
| 1 |
Ab initio vibrational spectrum of ( 2 Σ + ) He – MgH 2 +
|
Page, Alister J.
|
|
2009
|
468 |
4-6 |
p. 299-306
8 p.
|
artikel
|
| 2 |
Achieving energy conservation in Poisson–Boltzmann molecular dynamics: Accuracy and precision with finite-difference algorithms
|
Wang, Jun
|
|
2009
|
468 |
4-6 |
p. 112-118
7 p.
|
artikel
|
| 3 |
A comparative study of modern and robust computational methods applied to π -complexes of moderate size: The case of the ethene/benzenium ion complex
|
Sancho-García, J.C.
|
|
2009
|
468 |
4-6 |
p. 138-142
5 p.
|
artikel
|
| 4 |
Acquisition of ultra-wideline NMR spectra from quadrupolar nuclei by frequency stepped WURST–QCPMG
|
O’Dell, Luke A.
|
|
2009
|
468 |
4-6 |
p. 330-335
6 p.
|
artikel
|
| 5 |
Angular electronic ‘band structure’ of molecules
|
Pavlyukh, Y.
|
|
2009
|
468 |
4-6 |
p. 313-318
6 p.
|
artikel
|
| 6 |
A time resolved study of S1/S2 electronic coupling in naphthalene
|
Montero, Raúl
|
|
2009
|
468 |
4-6 |
p. 134-137
4 p.
|
artikel
|
| 7 |
Atomic configurations of Pd atoms in PdAu(111) and PdAu(100) surface alloys: Ab initio density functional calculations
|
Gotsis, H.J.
|
|
2009
|
468 |
4-6 |
p. 162-165
4 p.
|
artikel
|
| 8 |
Author Index
|
|
|
2009
|
468 |
4-6 |
p. 336-341
6 p.
|
artikel
|
| 9 |
Basis set requirements for interactions in ionic systems: LiCl
|
Mintz, Benjamin
|
|
2009
|
468 |
4-6 |
p. 286-289
4 p.
|
artikel
|
| 10 |
Chromium difluoride: Probing the limits of structure determination
|
Vest, Brian
|
|
2009
|
468 |
4-6 |
p. 143-147
5 p.
|
artikel
|
| 11 |
Contents
|
|
|
2009
|
468 |
4-6 |
p. iii-xiv
nvt p.
|
artikel
|
| 12 |
Core electron chemical shifts of hydrogen-bonded structures
|
Tu, Guangde
|
|
2009
|
468 |
4-6 |
p. 294-298
5 p.
|
artikel
|
| 13 |
Determination of the time-dependent OH-yield by using a fluorescent probe. Application to heavy ion irradiation
|
Baldacchino, G.
|
|
2009
|
468 |
4-6 |
p. 275-279
5 p.
|
artikel
|
| 14 |
Direct mass spectrometry investigation on Pentacene thin film oxidation upon exposure to air
|
De Angelis, F.
|
|
2009
|
468 |
4-6 |
p. 193-196
4 p.
|
artikel
|
| 15 |
Editorial Board
|
|
|
2009
|
468 |
4-6 |
p. IFC-
1 p.
|
artikel
|
| 16 |
EELS femtosecond resolved in 4D ultrafast electron microscopy
|
Carbone, Fabrizio
|
|
2009
|
468 |
4-6 |
p. 107-111
5 p.
|
artikel
|
| 17 |
Electrical conductivity measurement of silicon wire prepared by CVD
|
Suzuki, Hiroshi
|
|
2009
|
468 |
4-6 |
p. 211-215
5 p.
|
artikel
|
| 18 |
Electronic states of SiC−: A theoretical study
|
Pramanik, Anup
|
|
2009
|
468 |
4-6 |
p. 124-128
5 p.
|
artikel
|
| 19 |
Emergence of valence band structure in rare-gas clusters
|
Rolles, D.
|
|
2009
|
468 |
4-6 |
p. 148-152
5 p.
|
artikel
|
| 20 |
EPR investigation of local structure for [Mn(H2O)6]2+ cluster in [M(H2O)6]XCl6:Mn2+ (M=Zn, Mg, Cd, Ca; X=Pt, Sn) systems at different temperatures
|
Tian, Wen-Yan
|
|
2009
|
468 |
4-6 |
p. 325-329
5 p.
|
artikel
|
| 21 |
Fluorination effects on structure and dynamics of phospholipid bilayer: A molecular dynamics study
|
Saito, Hiroaki
|
|
2009
|
468 |
4-6 |
p. 260-263
4 p.
|
artikel
|
| 22 |
Fluorine addition to single-wall carbon nanotubes revisited
|
Claves, Daniel
|
|
2009
|
468 |
4-6 |
p. 231-233
3 p.
|
artikel
|
| 23 |
Half metallicity in a zigzag double-walled nanotube nanodot: An ab initio prediction
|
Du, A.J.
|
|
2009
|
468 |
4-6 |
p. 257-259
3 p.
|
artikel
|
| 24 |
Hydration of ions containing aliphatic chains
|
Burakowski, Andrzej
|
|
2009
|
468 |
4-6 |
p. 184-187
4 p.
|
artikel
|
| 25 |
Intermolecular potential and ab initio spectroscopy of the Ne–HF complex
|
Tulegenov, A.S.
|
|
2009
|
468 |
4-6 |
p. 290-293
4 p.
|
artikel
|
| 26 |
Luminescence and local structure of Mn-doped ZnS hybrid crystal with two-dimensional platelet morphology
|
Jang, Jum Suk
|
|
2009
|
468 |
4-6 |
p. 253-256
4 p.
|
artikel
|
| 27 |
Mass spectra of methyl acetate and ethyl formate
|
Liu, Min
|
|
2009
|
468 |
4-6 |
p. 153-157
5 p.
|
artikel
|
| 28 |
Metastable impurity perturbed states of 2D single carrier quantum dots
|
Hazra, Ram Kuntal
|
|
2009
|
468 |
4-6 |
p. 216-221
6 p.
|
artikel
|
| 29 |
Near infrared laser spectroscopy of solid parahydrogen: The crystal-field splitting of rovibrational W 1(0) transition
|
Chan, Man-Chor
|
|
2009
|
468 |
4-6 |
p. 166-170
5 p.
|
artikel
|
| 30 |
New insights on the reaction mechanisms for CO oxidation on Au catalysts
|
Molina, L.M.
|
|
2009
|
468 |
4-6 |
p. 201-204
4 p.
|
artikel
|
| 31 |
Nitrous acid under high temperature and pressure – From atomistic simulations to equation of state for thermochemical modeling
|
Maiti, A.
|
|
2009
|
468 |
4-6 |
p. 197-200
4 p.
|
artikel
|
| 32 |
On fluorescence blinking of single molecules in polymers
|
Ishitobi, Hidekazu
|
|
2009
|
468 |
4-6 |
p. 234-238
5 p.
|
artikel
|
| 33 |
On the chain length effect: Comparative reactivity of a macroradical and a radical
|
Lalevée, J.
|
|
2009
|
468 |
4-6 |
p. 227-230
4 p.
|
artikel
|
| 34 |
Pattern transition between periodic Liesegang pattern and crystal growth regime in reaction–diffusion systems
|
Lagzi, István
|
|
2009
|
468 |
4-6 |
p. 188-192
5 p.
|
artikel
|
| 35 |
Photophysical properties of Re(pbt)(CO)4 studied by high resolution spectroscopy
|
Czerwieniec, Rafał
|
|
2009
|
468 |
4-6 |
p. 205-210
6 p.
|
artikel
|
| 36 |
Picosecond time-resolved fluorescence study of poly vinyl methyl ether aqueous solution
|
Sakamaki, Tsutomu
|
|
2009
|
468 |
4-6 |
p. 171-175
5 p.
|
artikel
|
| 37 |
Polarizable model of chloroform based on classical Drude oscillators
|
Lamoureux, Guillaume
|
|
2009
|
468 |
4-6 |
p. 270-274
5 p.
|
artikel
|
| 38 |
Preparation and size optimisation of silica nanoparticles using statistical analyses
|
Davies, Gemma-Louise
|
|
2009
|
468 |
4-6 |
p. 239-244
6 p.
|
artikel
|
| 39 |
Raman spectroscopy of formic acid and its dimers isolated in low temperature argon matrices
|
Olbert-Majkut, Adriana
|
|
2009
|
468 |
4-6 |
p. 176-183
8 p.
|
artikel
|
| 40 |
Relation between bond order and delocalization index of QTAIM
|
Firme, Caio L.
|
|
2009
|
468 |
4-6 |
p. 129-133
5 p.
|
artikel
|
| 41 |
Resonance enhanced Raman scattering from the complex electric-dipole polarizability: A theoretical study on N2
|
Mohammed, Abdelsalam
|
|
2009
|
468 |
4-6 |
p. 119-123
5 p.
|
artikel
|
| 42 |
Scanning tunneling spectroscopy of gold nanoparticles: Influences of volatile organic vapors and particle core dimensions
|
Xu, Li-Ping
|
|
2009
|
468 |
4-6 |
p. 222-226
5 p.
|
artikel
|
| 43 |
Shape stability of InAs self-assembled islands on vicinal GaAs(001) substrates
|
Liang, S.
|
|
2009
|
468 |
4-6 |
p. 249-252
4 p.
|
artikel
|
| 44 |
Size-controlled synthesis of monodisperse gold nanooctahedrons and their surface-enhanced Raman scattering properties
|
Kim, Dongheun
|
|
2009
|
468 |
4-6 |
p. 245-248
4 p.
|
artikel
|
| 45 |
Strong-field ionization of sputtered molecules for biomolecular imaging
|
Willingham, D.
|
|
2009
|
468 |
4-6 |
p. 264-269
6 p.
|
artikel
|
| 46 |
The charge transfer anion-radical alkali-metal salts M+TCNQ− (M=Li,Na,K): The structures and static hyperpolarizabilities
|
Li, Zong-Jun
|
|
2009
|
468 |
4-6 |
p. 319-324
6 p.
|
artikel
|
| 47 |
The DFT+U method in the linear combination of Gaussian-type orbitals framework: Role of 4f orbitals in the bonding of LuF3
|
Ramakrishnan, Raghunathan
|
|
2009
|
468 |
4-6 |
p. 158-161
4 p.
|
artikel
|
| 48 |
The MC-DFT approach to the M06-2X, B2K-PLYP, and B2T-PLYP functionals
|
Chen, Jien-Lian
|
|
2009
|
468 |
4-6 |
p. 307-312
6 p.
|
artikel
|
| 49 |
Theoretical and crystallographic study of edge-to-face aromatic interactions between pyridine moieties and benzene
|
Escudero, Daniel
|
|
2009
|
468 |
4-6 |
p. 280-285
6 p.
|
artikel
|
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