| nr |
titel |
auteur |
tijdschrift |
jaar |
jaarg. |
afl. |
pagina('s) |
type |
| 1 |
Ab initio MO and quasi-classical direct ab initio MD studies on the nitrogen inversion of trimethylamine
|
Tanaka, Masato
|
|
2006
|
417 |
4-6 |
p. 316-319
4 p.
|
artikel
|
| 2 |
Absolute line intensity with FT-ICLAS: 12C2H2 near 12800cm−1
|
Macko, P.
|
|
2006
|
417 |
4-6 |
p. 471-474
4 p.
|
artikel
|
| 3 |
Absolute rate determinations and temperature dependences of the gas-phase reactions of O(3P) with halogenated propenes
|
Cometto, Pablo M.
|
|
2006
|
417 |
4-6 |
p. 480-485
6 p.
|
artikel
|
| 4 |
Adsorption of Cu4, Ag4 and Au4 particles on the regular MgO(001) surface: A density functional study using embedded cluster models
|
Inntam, Chan
|
|
2006
|
417 |
4-6 |
p. 515-520
6 p.
|
artikel
|
| 5 |
A first-principles study of the chemi-adsorption of benzene on Au(100) surface
|
Chen, Wen-Kai
|
|
2006
|
417 |
4-6 |
p. 414-418
5 p.
|
artikel
|
| 6 |
Ambipolar single electron transistors using side-contacted single-walled carbon nanotubes
|
Matsuoka, Kenta
|
|
2006
|
417 |
4-6 |
p. 540-544
5 p.
|
artikel
|
| 7 |
A multi state-CASPT2 vs. TD-DFT study of the electronic excited states of RCo(CO)4 (R=H, CH3) organometallic complexes
|
Ambrosek, David
|
|
2006
|
417 |
4-6 |
p. 545-549
5 p.
|
artikel
|
| 8 |
An ‘Atoms in Molecules’ analysis of the differences between meso and chiral forms of oxirane and cyclobutene derivatives
|
Alkorta, Ibon
|
|
2006
|
417 |
4-6 |
p. 367-370
4 p.
|
artikel
|
| 9 |
A study of the dispersions of metal oxide nanowires in polar solvents
|
Deepak, F.L.
|
|
2006
|
417 |
4-6 |
p. 535-539
5 p.
|
artikel
|
| 10 |
A study of the non-electrostatic interaction micelle/charged ligand: A comparison of the results obtained by two different methods
|
Jiménez, R.
|
|
2006
|
417 |
4-6 |
p. 509-514
6 p.
|
artikel
|
| 11 |
Asymmetric current–voltage characteristics of molecular junctions containing bipolar molecules
|
Gasyna, Zbigniew L.
|
|
2006
|
417 |
4-6 |
p. 401-405
5 p.
|
artikel
|
| 12 |
A theoretical ab initio study of [n.n]paracyclophane complexes with cations
|
Frontera, Antonio
|
|
2006
|
417 |
4-6 |
p. 371-377
7 p.
|
artikel
|
| 13 |
Author Index
|
|
|
2006
|
417 |
4-6 |
p. 573-582
10 p.
|
artikel
|
| 14 |
Bound state solutions of the Schrödinger equation for modified Kratzer’s molecular potential
|
Berkdemir, Cüneyt
|
|
2006
|
417 |
4-6 |
p. 326-329
4 p.
|
artikel
|
| 15 |
Cavity ringdown spectroscopy of the A ˜ – X ˜ electronic transition of the phenyl peroxy radical
|
Just, Gabriel M.P.
|
|
2006
|
417 |
4-6 |
p. 378-382
5 p.
|
artikel
|
| 16 |
Characterization of N-representable n-particle densities when N is infinite
|
Pistol, Mats-Erik
|
|
2006
|
417 |
4-6 |
p. 521-523
3 p.
|
artikel
|
| 17 |
Comment on “The enthalpy of the O–H homolytic dissociation: Basis-set extrapolated density functional theory and coupled cluster calculations” by B.J. Costa Cabral and S. Canuto [Chem. Phys. Lett. 406 (2005) 300–305]
|
DiLabio, Gino A.
|
|
2006
|
417 |
4-6 |
p. 566-569
4 p.
|
artikel
|
| 18 |
Controlling the Ru-catalyzed Belousov–Zhabotinsky reaction by addition of hydroquinone
|
Huh, Do Sung
|
|
2006
|
417 |
4-6 |
p. 555-560
6 p.
|
artikel
|
| 19 |
Covalent attachment of quantum dot on carbon nanotubes
|
Pan, Bifeng
|
|
2006
|
417 |
4-6 |
p. 419-424
6 p.
|
artikel
|
| 20 |
Editorial Board
|
|
|
2006
|
417 |
4-6 |
p. CO2-
1 p.
|
artikel
|
| 21 |
Effects of ions on dynamics of ice surface
|
Ikeda-Fukazawa, Tomoko
|
|
2006
|
417 |
4-6 |
p. 561-565
5 p.
|
artikel
|
| 22 |
Electrically triggered insertion of single-stranded DNA into single-walled carbon nanotubes
|
Okada, Takeru
|
|
2006
|
417 |
4-6 |
p. 288-292
5 p.
|
artikel
|
| 23 |
Enhanced photoluminescence from films made of titanium tetraisopropoxide, Eu3+ ions and thenoyltrifluoroacetone blends
|
Stathatos, Elias
|
|
2006
|
417 |
4-6 |
p. 406-409
4 p.
|
artikel
|
| 24 |
Evolution of chemical gardens in aqueous solutions of polymers
|
Bormashenko, Edward
|
|
2006
|
417 |
4-6 |
p. 341-344
4 p.
|
artikel
|
| 25 |
Excited state enhancement of non-linear optical response in the push–pull imide and diimide chromophores
|
Keinan, Shahar
|
|
2006
|
417 |
4-6 |
p. 293-296
4 p.
|
artikel
|
| 26 |
Explore water’s protective and assistant role for uracil: A changing role of water at different temperature
|
Hu, Xingbang
|
|
2006
|
417 |
4-6 |
p. 320-325
6 p.
|
artikel
|
| 27 |
Femtosecond time-resolved solvation process of a solution: Constraints of vibrational degrees of freedom in the supercooled state
|
Murakami, Hiroshi
|
|
2006
|
417 |
4-6 |
p. 550-554
5 p.
|
artikel
|
| 28 |
Fluorescence resonance energy transfer induced by conjugation of metalloproteins to nanoparticles
|
Pompa, P.P.
|
|
2006
|
417 |
4-6 |
p. 351-357
7 p.
|
artikel
|
| 29 |
Formation of double-side teethed nanocombs of ZnO and self-catalysis of Zn-terminated polar surface
|
Lao, Chang Shi
|
|
2006
|
417 |
4-6 |
p. 358-362
5 p.
|
artikel
|
| 30 |
Growth and fluorescence properties of perylene nanocrystals produced by ultra-rapid evaporation
|
Wakayama, Y.
|
|
2006
|
417 |
4-6 |
p. 503-508
6 p.
|
artikel
|
| 31 |
Implicit and explicit internal signal stochastic resonance in calcium ion oscillations
|
Li, Ya Ping
|
|
2006
|
417 |
4-6 |
p. 498-502
5 p.
|
artikel
|
| 32 |
Intermolecular structure and dynamics in an ionic liquid: A Car–Parrinello molecular dynamics simulation study of 1,3-dimethylimidazolium chloride
|
Bhargava, B.L.
|
|
2006
|
417 |
4-6 |
p. 486-491
6 p.
|
artikel
|
| 33 |
Investigation of the liquid–liquid interface with high spatial resolution using near-field Raman spectroscopy
|
De Serio, M.
|
|
2006
|
417 |
4-6 |
p. 452-456
5 p.
|
artikel
|
| 34 |
Isothermal–isobaric Monte Carlo simulations of liquid lithium using density functional theory
|
Gelb, Lev D.
|
|
2006
|
417 |
4-6 |
p. 283-287
5 p.
|
artikel
|
| 35 |
Iterative time independent calculation of the cumulative reaction probability within a basis adapted preconditioner
|
Woittequand, F.
|
|
2006
|
417 |
4-6 |
p. 492-497
6 p.
|
artikel
|
| 36 |
Local structural effects on low-frequency vibrational spectrum of liquid water: The instantaneous-normal-mode analysis
|
Tsai, K.H.
|
|
2006
|
417 |
4-6 |
p. 389-394
6 p.
|
artikel
|
| 37 |
Luminescent properties and excitation mechanism of organic–inorganic single quantum well containing organic heterojunction
|
Qian, Lei
|
|
2006
|
417 |
4-6 |
p. 441-444
4 p.
|
artikel
|
| 38 |
Mixed cation effect in 0.3[xLi2O·(1− x) R2O]·0.7B2O3 (R=Na, K, Rb) glasses
|
Gao, Yong
|
|
2006
|
417 |
4-6 |
p. 430-433
4 p.
|
artikel
|
| 39 |
Observing the complete solvation response of DCS in imidazolium ionic liquids, from the femtosecond to nanosecond regimes
|
Arzhantsev, Sergei
|
|
2006
|
417 |
4-6 |
p. 524-529
6 p.
|
artikel
|
| 40 |
On the carbon-13 chemical shift tensors of bent-core mesogens
|
Dong, Ronald Y.
|
|
2006
|
417 |
4-6 |
p. 475-479
5 p.
|
artikel
|
| 41 |
Optical limiting with soluble two-photon absorbing quadrupoles: Structure–property relationships
|
Charlot, Marina
|
|
2006
|
417 |
4-6 |
p. 297-302
6 p.
|
artikel
|
| 42 |
Picosecond fluorescence dynamics of auramine with a long aliphatic chain
|
Pereira, Robson Valentim
|
|
2006
|
417 |
4-6 |
p. 425-429
5 p.
|
artikel
|
| 43 |
Reduced parameter set determinable from geminate kinetics
|
Agmon, Noam
|
|
2006
|
417 |
4-6 |
p. 530-534
5 p.
|
artikel
|
| 44 |
Reply to comment on ‘The enthalpy of the O–H bond homolytic dissociation: Basis-set extrapolated density functional theory and coupled cluster calculations’
|
Cabral, B.J. Costa
|
|
2006
|
417 |
4-6 |
p. 570-572
3 p.
|
artikel
|
| 45 |
Some important formulae using the concept of graphical tree
|
Mandal, Bholanath
|
|
2006
|
417 |
4-6 |
p. 395-400
6 p.
|
artikel
|
| 46 |
Spectral properties of bipyridyl ligands by time-dependent density functional theory
|
Labat, Frédéric
|
|
2006
|
417 |
4-6 |
p. 445-451
7 p.
|
artikel
|
| 47 |
Spincoated polyethylene films for single-molecule optics
|
Wirtz, A.C.
|
|
2006
|
417 |
4-6 |
p. 383-388
6 p.
|
artikel
|
| 48 |
Strong quantum confinement effects in thin zinc selenide films
|
Baskoutas, S.
|
|
2006
|
417 |
4-6 |
p. 461-464
4 p.
|
artikel
|
| 49 |
Submicron-resolving infrared absorption spectroscopy and analysis in fingerprint region utilizing a free electron laser
|
Masaki, Tatsuhiro
|
|
2006
|
417 |
4-6 |
p. 410-413
4 p.
|
artikel
|
| 50 |
Syntheses and aggregate behaviors of liquid crystalline alkoxycarbonyl substituted perylenes
|
Mo, Xiong
|
|
2006
|
417 |
4-6 |
p. 457-460
4 p.
|
artikel
|
| 51 |
The lowest quartet electronic states of MnC
|
Borin, Antonio Carlos
|
|
2006
|
417 |
4-6 |
p. 334-340
7 p.
|
artikel
|
| 52 |
Theoretical study and rate constants calculation for the ClCH2OH+Cl reaction
|
Ji, Yue-Meng
|
|
2006
|
417 |
4-6 |
p. 345-350
6 p.
|
artikel
|
| 53 |
Theoretical study of proton transfer reactions of halosulfonic acids with ammonia in hydrated clusters
|
Li, Shujin
|
|
2006
|
417 |
4-6 |
p. 434-440
7 p.
|
artikel
|
| 54 |
Theoretical study of the tandem cross-linkage lesion in DNA
|
Zhang, Ru bo
|
|
2006
|
417 |
4-6 |
p. 303-308
6 p.
|
artikel
|
| 55 |
The origin of the band at ∼1025cm−1 in the SERS of pyridine adsorbed on silver
|
Muniz-Miranda, Maurizio
|
|
2006
|
417 |
4-6 |
p. 330-333
4 p.
|
artikel
|
| 56 |
The role of magnetic fields on the membrane-based separation of aqueous electrolyte solutions
|
Murad, S.
|
|
2006
|
417 |
4-6 |
p. 465-470
6 p.
|
artikel
|
| 57 |
UV absorption spectrum, formation and disappearance of the oxide radical ion O − in aqueous solution: A pulse radiolysis study
|
Alam, M.S.
|
|
2006
|
417 |
4-6 |
p. 363-366
4 p.
|
artikel
|
| 58 |
What role do oxonium ions and oxonium ylides play in the ZSM-5 catalysed methanol-to-olefin process?
|
Lesthaeghe, D.
|
|
2006
|
417 |
4-6 |
p. 309-315
7 p.
|
artikel
|
Tijdschrift beschrijving