nr |
titel |
auteur |
tijdschrift |
jaar |
jaarg. |
afl. |
pagina('s) |
type |
1 |
Algebraic relationships between conceptual DFT quantities and the electronegativity equalization hardness matrix
|
Bultinck, Patrick |
|
2002 |
364 |
3-4 |
p. 357-362 6 p. |
artikel |
2 |
Calculation of ground and excited state potential energy curves of the MgAr complex using the coupled cluster approximate triples model CC3
|
Hald, Kasper |
|
2002 |
364 |
3-4 |
p. 402-408 7 p. |
artikel |
3 |
Dependence of porosity in methyl-silsesquioxane thin films on molecular weight of sacrificial triblock copolymer
|
Xu, Jun |
|
2002 |
364 |
3-4 |
p. 309-313 5 p. |
artikel |
4 |
Dipole and quadrupole moments of liquid water calculated within the coupled cluster/molecular mechanics method
|
Kongsted, Jacob |
|
2002 |
364 |
3-4 |
p. 379-386 8 p. |
artikel |
5 |
Dispersion of single wall carbon nanotubes by in situ polymerization under sonication
|
Park, Cheol |
|
2002 |
364 |
3-4 |
p. 303-308 6 p. |
artikel |
6 |
Editorial Board
|
|
|
2002 |
364 |
3-4 |
p. IFC- 1 p. |
artikel |
7 |
Geometry optimization of C n (n=2–30) with genetic algorithm
|
Zhang, Congjie |
|
2002 |
364 |
3-4 |
p. 213-219 7 p. |
artikel |
8 |
High purity single crystalline boron carbide nanowires
|
Ma, Renzhi |
|
2002 |
364 |
3-4 |
p. 314-317 4 p. |
artikel |
9 |
Influence of oxygen dissolution history on reconstruction behavior of a stepped metal surface
|
Pearl, T.P |
|
2002 |
364 |
3-4 |
p. 284-289 6 p. |
artikel |
10 |
Investigation of some amino acids conformations at the interface of binary mixture using the solvation free energy density model
|
Nam, Ky-Youb |
|
2002 |
364 |
3-4 |
p. 267-272 6 p. |
artikel |
11 |
Investigations on anodic photocurrent loss processes in dye sensitized solar cells: comparison between nanocrystalline SnO2 and TiO2 films
|
Tachibana, Yasuhiro |
|
2002 |
364 |
3-4 |
p. 297-302 6 p. |
artikel |
12 |
Mass transport of alkali metal in reaction fronts on a catalytic metal surface
|
Marbach, H. |
|
2002 |
364 |
3-4 |
p. 207-212 6 p. |
artikel |
13 |
Non-Arrhenius surface temperature dependence in vibrational excitation of NO on Au(111): possible evidence for the importance of surface electronic states
|
Wodtke, Alec M. |
|
2002 |
364 |
3-4 |
p. 231-236 6 p. |
artikel |
14 |
Novel species for the sulfur zoo: isomers of S8
|
Wong, Ming Wah |
|
2002 |
364 |
3-4 |
p. 387-392 6 p. |
artikel |
15 |
Observation of photon cascade emission in Pr3+-doped LuF3 and BaMgF4
|
Kück, S. |
|
2002 |
364 |
3-4 |
p. 273-278 6 p. |
artikel |
16 |
Optical properties of WO3 doped congruent LiNbO3 crystals
|
Han, T.P.J |
|
2002 |
364 |
3-4 |
p. 323-327 5 p. |
artikel |
17 |
Perturbation calculations of the van der Waals potentials of He(2 3S, 2 1S) metastable atoms with rare gas atoms
|
Patil, S.H. |
|
2002 |
364 |
3-4 |
p. 371-378 8 p. |
artikel |
18 |
Photochemical induced effects in material ejection in laser ablation
|
Yingling, Yaroslava G |
|
2002 |
364 |
3-4 |
p. 237-243 7 p. |
artikel |
19 |
Probing interactions between TiO2 photocatalyst and adsorbing species using quartz crystal microbalance
|
Morand, R |
|
2002 |
364 |
3-4 |
p. 244-250 7 p. |
artikel |
20 |
Pseudo-π currents: rapid and accurate visualisation of ring currents in conjugated hydrocarbons
|
Fowler, P.W |
|
2002 |
364 |
3-4 |
p. 259-266 8 p. |
artikel |
21 |
Reactions of N2O with Li n in the gas-phase and on the surfaces of large Ar n clusters
|
Breckenridge, W.H. |
|
2002 |
364 |
3-4 |
p. 225-230 6 p. |
artikel |
22 |
Relation between hyper-Wiener and Wiener index
|
Gutman, Ivan |
|
2002 |
364 |
3-4 |
p. 352-356 5 p. |
artikel |
23 |
Reversible switching of molecular second-order nonlinear optical polarizability through proton-transfer
|
Asselberghs, Inge |
|
2002 |
364 |
3-4 |
p. 279-283 5 p. |
artikel |
24 |
Self-assembly of the [60]fullerene-substituted oligopyridines on Au nanoparticles and the optical nonlinearities of the nanoparticles
|
Fang, Hongjuan |
|
2002 |
364 |
3-4 |
p. 290-296 7 p. |
artikel |
25 |
Silicon nanotubes: Why not?
|
Zhang, R.Q |
|
2002 |
364 |
3-4 |
p. 251-258 8 p. |
artikel |
26 |
Spectroscopic and volumetric characterization of a non-microporous amorphous ice
|
Manca, C |
|
2002 |
364 |
3-4 |
p. 220-224 5 p. |
artikel |
27 |
Synthesis, crystal structure and magnetic properties of a novel nitroxide biradical. Theoretical investigation of the exchange mechanisms
|
Fritscher, Jörg |
|
2002 |
364 |
3-4 |
p. 393-401 9 p. |
artikel |
28 |
The electronic structure and its theoretical simulation of carbon nanotube with finited length. Part I: the frontier orbitals and its properties of short armchair nanotubes
|
Li, Junqian |
|
2002 |
364 |
3-4 |
p. 328-337 10 p. |
artikel |
29 |
The electronic structure and its theoretical simulation of carbon nanotube with finite length. Part II: the energy gap and its oscillation properties of short armchair nanotubes
|
Li, Junqian |
|
2002 |
364 |
3-4 |
p. 338-344 7 p. |
artikel |
30 |
The infrared spectrum of Al+–benzene in the gas phase
|
van Heijnsbergen, D |
|
2002 |
364 |
3-4 |
p. 345-351 7 p. |
artikel |
31 |
The interpretation of X-ray absorption spectra of water and ice
|
Cavalleri, M |
|
2002 |
364 |
3-4 |
p. 363-370 8 p. |
artikel |
32 |
The reaction profile for hydrogen atom transfer from phenol to peroxyl free radicals
|
O’Malley, Patrick J. |
|
2002 |
364 |
3-4 |
p. 318-322 5 p. |
artikel |
33 |
Thermogravimetric analysis of single-wall carbon nanotubes ultrasonicated in monochlorobenzene
|
Zhang, Minfang |
|
2002 |
364 |
3-4 |
p. 420-426 7 p. |
artikel |
34 |
Variational density matrix functional calculations for the corrected Hartree and corrected Hartree–Fock functionals
|
Cohen, A.J. |
|
2002 |
364 |
3-4 |
p. 409-419 11 p. |
artikel |