| nr |
titel |
auteur |
tijdschrift |
jaar |
jaarg. |
afl. |
pagina('s) |
type |
| 1 |
A density functional theory study of the interaction of oxygen with a reduced SnO2 (110) surface
|
Yamaguchi, Yoichi
|
|
2000
|
316 |
5-6 |
p. 477-482
6 p.
|
artikel
|
| 2 |
An ab initio and density functional study on the ring-chain tautomerism of (Z)-3-formyl-acrylic acid
|
Škrinárová, Zuzana
|
|
2000
|
316 |
5-6 |
p. 531-535
5 p.
|
artikel
|
| 3 |
A new and simple method for thin graphitic coating of magnetic-metal nanoparticles
|
Tomita, Satoshi
|
|
2000
|
316 |
5-6 |
p. 361-364
4 p.
|
artikel
|
| 4 |
Anomalous migration of DNA
|
Mohanty, Jayanta F
|
|
2000
|
316 |
5-6 |
p. 558-562
5 p.
|
artikel
|
| 5 |
Ar-induced pressure effects in the ν 1+3ν 3 absorption band in 12 C 2 H2
|
Herregodts, F
|
|
2000
|
316 |
5-6 |
p. 460-464
5 p.
|
artikel
|
| 6 |
Bivalent cation binding effect on formation of the peptide bond
|
Remko, Milan
|
|
2000
|
316 |
5-6 |
p. 489-494
6 p.
|
artikel
|
| 7 |
Density functional theory and resonance Raman investigation of the ultraviolet electronic excited states of CF2I2
|
Zheng, Xuming
|
|
2000
|
316 |
5-6 |
p. 524-530
7 p.
|
artikel
|
| 8 |
Electronic structure of Eu@C60 studied by XANES and UV–VIS absorption spectra
|
Inoue, T.
|
|
2000
|
316 |
5-6 |
p. 381-386
6 p.
|
artikel
|
| 9 |
Electron transfer between adjacent layers in self-assembled films
|
Leite, Vitor B.P.
|
|
2000
|
316 |
5-6 |
p. 343-348
6 p.
|
artikel
|
| 10 |
Enhancement of magnetic field effect in Ru(bpy)3 2+/MV2+ system by Ru(bpy)3 2+-Ag+ exciplex formation
|
Fodor, Lajos
|
|
2000
|
316 |
5-6 |
p. 411-418
8 p.
|
artikel
|
| 11 |
Evidence for an adsorbate-dependent mechanism for surface resistivity: formic acid, oxygen and CO on Cu(100)
|
Hsu, Ching-Ling
|
|
2000
|
316 |
5-6 |
p. 336-342
7 p.
|
artikel
|
| 12 |
Hybridization peaks in Pt–Cl XANES 1 Supported in part by the US DOE and by UOP LLC. 1
|
Ankudinov, A.L.
|
|
2000
|
316 |
5-6 |
p. 495-500
6 p.
|
artikel
|
| 13 |
Index
|
|
|
2000
|
316 |
5-6 |
p. 593-602
10 p.
|
artikel
|
| 14 |
Induced HSiCl emission in the UV photodissociation of 2-chloroethenylsilane
|
de Nalda, Rebeca
|
|
2000
|
316 |
5-6 |
p. 449-454
6 p.
|
artikel
|
| 15 |
Isotope effects in the deactivation of O( 1 D) atoms by XCl and XF (X=H,D)
|
Chichinin, A.I.
|
|
2000
|
316 |
5-6 |
p. 425-432
8 p.
|
artikel
|
| 16 |
IVR in the S1 state of jet-cooled cis- and trans-p-dimethoxybenzene
|
Patwari, G.N.
|
|
2000
|
316 |
5-6 |
p. 433-441
9 p.
|
artikel
|
| 17 |
Liquid tin tetrachloride: a Monte Carlo simulation study
|
Rocha, Willian R.
|
|
2000
|
316 |
5-6 |
p. 510-516
7 p.
|
artikel
|
| 18 |
Modelling the 13 C NMR chemical shifts of C84 fullerenes
|
Heine, T.
|
|
2000
|
316 |
5-6 |
p. 373-380
8 p.
|
artikel
|
| 19 |
Non-linear response and hydrogen bond dynamics for electron solvation in methanol
|
Turi, László
|
|
2000
|
316 |
5-6 |
p. 465-470
6 p.
|
artikel
|
| 20 |
Observation of two paramagnetic species in electron transfer reactions within cesium modified X and Y zeolites
|
Samoilova, Rimma I.
|
|
2000
|
316 |
5-6 |
p. 404-410
7 p.
|
artikel
|
| 21 |
One approach to the control of intramolecular hydrogen transfer
|
Ohta, Y.
|
|
2000
|
316 |
5-6 |
p. 551-557
7 p.
|
artikel
|
| 22 |
On the relaxation of electron energy distribution function in LIBS plasmas
|
Capitelli, M.
|
|
2000
|
316 |
5-6 |
p. 517-523
7 p.
|
artikel
|
| 23 |
Photoelectron spectromicroscopy of electrochemically induced oxygen spillover at the Pt/YSZ interface
|
Luerßen, B.
|
|
2000
|
316 |
5-6 |
p. 331-335
5 p.
|
artikel
|
| 24 |
Photoionization and density functional theory study of clusters of acetone containing an alkali metal atom, M((CH3)2CO) n (M=Li, Na): intracluster electron transfer from metal to acetone in 1:1 complexes
|
Tsunoyama, Hironori
|
|
2000
|
316 |
5-6 |
p. 442-448
7 p.
|
artikel
|
| 25 |
Quantifying theory of optical orientation processes in spectrally distinguishable photoisomers: application to a spiropyran-type chromophore
|
Ishitobi, Hidekazu
|
|
2000
|
316 |
5-6 |
p. 578-584
7 p.
|
artikel
|
| 26 |
Radially modulated nitrogen distribution in CNx nanotubular structures prepared by CVD using Ni phthalocyanine
|
Suenaga, K.
|
|
2000
|
316 |
5-6 |
p. 365-372
8 p.
|
artikel
|
| 27 |
Rotational effects in the unimolecular dissociation of the acetyl radical
|
Martı́nez-Núñez, Emilio
|
|
2000
|
316 |
5-6 |
p. 471-476
6 p.
|
artikel
|
| 28 |
Stimulated 7 Li echo NMR spectroscopy of slow ionic motions in a solid electrolyte
|
Böhmer, R.
|
|
2000
|
316 |
5-6 |
p. 419-424
6 p.
|
artikel
|
| 29 |
Structure and growth of aligned carbon nanotube films by pyrolysis
|
Li, De-Chang
|
|
2000
|
316 |
5-6 |
p. 349-355
7 p.
|
artikel
|
| 30 |
Surface-induced reactions of C n +, 50⩽n⩽60
|
Fiegele, T
|
|
2000
|
316 |
5-6 |
p. 387-394
8 p.
|
artikel
|
| 31 |
The combination of density functional theory with multi-configuration methods – CAS-DFT
|
Gräfenstein, Jürgen
|
|
2000
|
316 |
5-6 |
p. 569-577
9 p.
|
artikel
|
| 32 |
The concerted trimerization of ethyne to benzene revisited
|
Cioslowski, Jerzy
|
|
2000
|
316 |
5-6 |
p. 536-540
5 p.
|
artikel
|
| 33 |
The coupled-cluster correction to multi-reference configuration interaction method: application to excited states
|
Meissner, Leszek
|
|
2000
|
316 |
5-6 |
p. 501-509
9 p.
|
artikel
|
| 34 |
The intermolecular interaction in the charge-transfer complex between NH3 and F2. A subtle case
|
Karpfen, Alfred
|
|
2000
|
316 |
5-6 |
p. 483-488
6 p.
|
artikel
|
| 35 |
Theoretical analysis of femtosecond excitation and fragmentation dynamics of Fe(CO)5
|
Rubner, O.
|
|
2000
|
316 |
5-6 |
p. 585-592
8 p.
|
artikel
|
| 36 |
Theoretical C–H bond dissociation enthalpies for CH3OCl and CH3OBr
|
Espinosa-Garcı́a, J
|
|
2000
|
316 |
5-6 |
p. 563-568
6 p.
|
artikel
|
| 37 |
Time-resolved resonance Raman and density functional study of the radical cations of chlorobiphenyls
|
Pan, Duohai
|
|
2000
|
316 |
5-6 |
p. 395-403
9 p.
|
artikel
|
| 38 |
Ultrafast photoinduced charge generation in conjugated polymers
|
Moses, Daniel
|
|
2000
|
316 |
5-6 |
p. 356-360
5 p.
|
artikel
|
| 39 |
Vibrational corrections to static electric properties of diatomics by Numerov–Cooley integration
|
Ingamells, Victoria E.
|
|
2000
|
316 |
5-6 |
p. 541-550
10 p.
|
artikel
|
| 40 |
Vibrational spectroscopy of the F−·H2O complex via argon predissociation: photoinduced, intracluster proton transfer?
|
Ayotte, Patrick
|
|
2000
|
316 |
5-6 |
p. 455-459
5 p.
|
artikel
|
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