| nr |
titel |
auteur |
tijdschrift |
jaar |
jaarg. |
afl. |
pagina('s) |
type |
| 1 |
Ab-initio study of the energetics and thermodynamics of the reaction CH 3 H + O(3 P) → CF 3 H … O → CF 3 + OH
|
Kreye, W.C.
|
|
1996
|
256 |
4-5 |
p. 383-390
8 p.
|
artikel
|
| 2 |
Absolute rate constants of Mo2 (X1 Σ g +) and Mo (a7S3) with O2 at room temperature
|
Wakabayashi, Tomohiro
|
|
1996
|
256 |
4-5 |
p. 543-547
5 p.
|
artikel
|
| 3 |
A new method for quantitative characterization of adsorbed hydrogen on Pt particles by means of Pt L-edge XANES
|
Kubota, T.
|
|
1996
|
256 |
4-5 |
p. 445-448
4 p.
|
artikel
|
| 4 |
A new simulation method for the determination of the vapour-liquid equilibria in the grand canonical ensemble
|
Boda, Dezsó
|
|
1996
|
256 |
4-5 |
p. 474-482
9 p.
|
artikel
|
| 5 |
Calculation of molecular electrostatic potentials and Fukui functions using density functional methods
|
De Proft, Frank
|
|
1996
|
256 |
4-5 |
p. 400-408
9 p.
|
artikel
|
| 6 |
Conformational equilibrium in resorcinol by means of the free-jet absorption millimeter wave spectrum
|
Melandri, Sonia
|
|
1996
|
256 |
4-5 |
p. 513-517
5 p.
|
artikel
|
| 7 |
Cross-precession induced by the average dipolar field in high-resolution NMR
|
Goldman, M.
|
|
1996
|
256 |
4-5 |
p. 497-501
5 p.
|
artikel
|
| 8 |
dc surface conductance as a tool for the study of the space charge layer of thin film semiconductor electrodes
|
Alcober, Carlos
|
|
1996
|
256 |
4-5 |
p. 431-437
7 p.
|
artikel
|
| 9 |
Electronic effects in the d-d spectrum of NiO
|
Lorda, Empar
|
|
1996
|
256 |
4-5 |
p. 377-382
6 p.
|
artikel
|
| 10 |
Free jet absorption millimeter wave spectrum of benzophenone
|
Maris, Assimo
|
|
1996
|
256 |
4-5 |
p. 509-512
4 p.
|
artikel
|
| 11 |
How to observe the elusive resonances in F + H2 reactive scattering
|
Russell, Caroline L.
|
|
1996
|
256 |
4-5 |
p. 465-473
9 p.
|
artikel
|
| 12 |
Influence of molecular vibrations on dissociative adsorption
|
Gross, Axel
|
|
1996
|
256 |
4-5 |
p. 417-423
7 p.
|
artikel
|
| 13 |
Intense radiation induced dissociation dynamics of a model diatomic molecule with randomly varying binding energy
|
Sarkar, Pranab
|
|
1996
|
256 |
4-5 |
p. 490-496
7 p.
|
artikel
|
| 14 |
Interconversion of a bisulfate anion into a sulfuric acid molecule on a Pt(111) electrode in a 0.5 M H2SO4 solution
|
Shingaya, Y.
|
|
1996
|
256 |
4-5 |
p. 438-444
7 p.
|
artikel
|
| 15 |
Laser emission from solutions and films containing semiconducting polymer and titanium dioxide nanocrystals
|
Hide, Fumitomo
|
|
1996
|
256 |
4-5 |
p. 424-430
7 p.
|
artikel
|
| 16 |
Localization of a charge transfer excited state in molecular crystals: a direct confirmation by femtosecond diffuse reflectance spectroscopy
|
Asahi, Tsuyoshi
|
|
1996
|
256 |
4-5 |
p. 525-530
6 p.
|
artikel
|
| 17 |
Molecular electronic properties of fused rigid porphyrin-oligomer molecular wires
|
Reimers, J.R.
|
|
1996
|
256 |
4-5 |
p. 353-359
7 p.
|
artikel
|
| 18 |
Nuclear spin-lattice relaxation and phase transitions in solid n-undecylammonium chloride
|
Reynhardt, E.C.
|
|
1996
|
256 |
4-5 |
p. 548-554
7 p.
|
artikel
|
| 19 |
Picosecond transient infrared spectroscopy of electronically excited 4-dimethylamino-4′-nitrostilbene in the fingerprint region (1640-940 cm−1)
|
Okamoto, Hiromi
|
|
1996
|
256 |
4-5 |
p. 502-508
7 p.
|
artikel
|
| 20 |
Rotational electrolyte friction on non-spherical polyions
|
Hernández-Contreras, M.
|
|
1996
|
256 |
4-5 |
p. 483-489
7 p.
|
artikel
|
| 21 |
Single crystal EPR study of the Ni center of NiFe hydrogenase
|
Geßner, Ch.
|
|
1996
|
256 |
4-5 |
p. 518-524
7 p.
|
artikel
|
| 22 |
Symmetry handling in calculations of properties of atoms in molecules
|
Cioslowski, Jerzy
|
|
1996
|
256 |
4-5 |
p. 449-453
5 p.
|
artikel
|
| 23 |
Theoretical study of molecular dynamics in model base pairs
|
Douhal, Abderrazzak
|
|
1996
|
256 |
4-5 |
p. 370-376
7 p.
|
artikel
|
| 24 |
The potential energy and dipole moment surfaces of HOBr
|
Palmieri, Paolo
|
|
1996
|
256 |
4-5 |
p. 409-416
8 p.
|
artikel
|
| 25 |
The rovibronic structure of Ni2 + via resonant two-color photodissociation
|
Bellert, D.
|
|
1996
|
256 |
4-5 |
p. 555-560
6 p.
|
artikel
|
| 26 |
Treatment of electronic excitations within the adiabatic approximation of time dependent density functional theory
|
Bauernschmitt, Rüdiger
|
|
1996
|
256 |
4-5 |
p. 454-464
11 p.
|
artikel
|
| 27 |
Triplet-triplet absorption of 2-(2′-hydroxyphenyl) benzoxazole (HBO) in polar solvents
|
Yang, Guoqiang
|
|
1996
|
256 |
4-5 |
p. 536-542
7 p.
|
artikel
|
| 28 |
Vibrational deactivation of N2 by inelastic collisions with 3He and 4He
|
Reid, J.P.
|
|
1996
|
256 |
4-5 |
p. 531-535
5 p.
|
artikel
|
| 29 |
Vibrational frequency prediction using density functional theory
|
Wong, Ming Wah
|
|
1996
|
256 |
4-5 |
p. 391-399
9 p.
|
artikel
|
| 30 |
Water molecule enhances dipole-bound electron affinity of 1-methyl-cytosine
|
Smets, Johan
|
|
1996
|
256 |
4-5 |
p. 360-369
10 p.
|
artikel
|
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