| nr |
titel |
auteur |
tijdschrift |
jaar |
jaarg. |
afl. |
pagina('s) |
type |
| 1 |
Ab initio calculations on the structure, vibrational frequencies, and valence excitation energies of the benzene…Ar and benzene…Ar2 cluster
|
Hobza, Pavel
|
|
1996
|
250 |
3-4 |
p. 402-408
7 p.
|
artikel
|
| 2 |
Ab initio study of AgNH3 and its cation
|
Ritze, H.-H.
|
|
1996
|
250 |
3-4 |
p. 415-420
6 p.
|
artikel
|
| 3 |
Ab initio study of the ground and several excited states of the NLi system
|
Matsika, Spyridoula
|
|
1996
|
250 |
3-4 |
p. 409-414
6 p.
|
artikel
|
| 4 |
A direct derivative MC-SCF procedure
|
Yamamoto, Naoko
|
|
1996
|
250 |
3-4 |
p. 373-378
6 p.
|
artikel
|
| 5 |
Application of density functional theory /Hartree-Fock hybrid methods. Geometries and bond dissociation energies of Al+ complexes
|
Stöckigt, Detlef
|
|
1996
|
250 |
3-4 |
p. 387-392
6 p.
|
artikel
|
| 6 |
A time-dependent approach to the nonradiative decay of polyatomic molecule: S1 to S0 transition of H2CO
|
Nakajima, Tohru
|
|
1996
|
250 |
3-4 |
p. 361-365
5 p.
|
artikel
|
| 7 |
Charge transfer in aminobenzonitriles: do they twist?
|
Sobolewski, Andrzej L.
|
|
1996
|
250 |
3-4 |
p. 428-436
9 p.
|
artikel
|
| 8 |
Effect of temperature in cerium-ion-catalyzed bromate-driven oscillators
|
Nagy, Gabriella
|
|
1996
|
250 |
3-4 |
p. 255-260
6 p.
|
artikel
|
| 9 |
Experimental detection of stacking faults in rare gas clusters
|
Kovalenko, S.I.
|
|
1996
|
250 |
3-4 |
p. 309-312
4 p.
|
artikel
|
| 10 |
Femtosecond elementary dynamics of transition states and asymmetric α-cleavage in Norrish reactions
|
Kim, Sang Kyu
|
|
1996
|
250 |
3-4 |
p. 279-286
8 p.
|
artikel
|
| 11 |
Fluorescence pattern recognition for ultrasensitive molecule identification: comparison of experimental data and theoretical approximations
|
Köllner, M.
|
|
1996
|
250 |
3-4 |
p. 355-360
6 p.
|
artikel
|
| 12 |
Ground and excited states of oxyheme: SAC/SAC-CI study
|
Nakatsuji, H.
|
|
1996
|
250 |
3-4 |
p. 379-386
8 p.
|
artikel
|
| 13 |
Induced paramagnetism and hyperfine interactions in the {[Fe4S4]-Fe} active site of Escherichia coli sulfite reductase
|
Belinsky, Moisey I.
|
|
1996
|
250 |
3-4 |
p. 320-327
8 p.
|
artikel
|
| 14 |
Infrared diode laser spectroscopy of C3: the ν 3 band of the a ̃ 3Π u electronic state
|
Hwang, C.H.
|
|
1996
|
250 |
3-4 |
p. 273-278
6 p.
|
artikel
|
| 15 |
In-situ infrared spectroscopy of water and electrolytes adsorbed on a Pt(111) electrode surface in acid solution. Structural changes of adsorbed water molecules upon an electrode potential
|
Hirota, Koji
|
|
1996
|
250 |
3-4 |
p. 335-341
7 p.
|
artikel
|
| 16 |
Intermolecular photoinduced proton transfer in nile blue and oxazine 720
|
Grofcsik, András
|
|
1996
|
250 |
3-4 |
p. 261-265
5 p.
|
artikel
|
| 17 |
Measurements of the effective lifetime of O atoms in atmospheric premixed flames
|
Ossler, F.
|
|
1996
|
250 |
3-4 |
p. 287-292
6 p.
|
artikel
|
| 18 |
Multi-partitioning Møller-Plesset perturbation theory. A state-selective formulation
|
Zaitsevskii, Andrei
|
|
1996
|
250 |
3-4 |
p. 366-372
7 p.
|
artikel
|
| 19 |
Observation of the infrared spectrum of the ν 3 band of the argon-ammonium ionic complex
|
Bieske, Evan J.
|
|
1996
|
250 |
3-4 |
p. 266-272
7 p.
|
artikel
|
| 20 |
On the performance of density functional methods for describing atomic populations, dipole moments and infrared intensities
|
De Proft, Frank
|
|
1996
|
250 |
3-4 |
p. 393-401
9 p.
|
artikel
|
| 21 |
Protonated water clusters and their black body radiation induced fragmentation
|
Schindler, Thomas
|
|
1996
|
250 |
3-4 |
p. 301-308
8 p.
|
artikel
|
| 22 |
Reaction of boron atoms with ethylene: ab initio study of the borirane radical
|
Hannachi, Yacine
|
|
1996
|
250 |
3-4 |
p. 421-427
7 p.
|
artikel
|
| 23 |
Steady-state heat and matter transfer at a non-uniform phase boundary
|
Phillips, L.F.
|
|
1996
|
250 |
3-4 |
p. 349-354
6 p.
|
artikel
|
| 24 |
The ESR spectrum and structure of a heteronuclear trimeric cluster, Au2Ag, prepared using a rotating cryostat
|
Mile, B.
|
|
1996
|
250 |
3-4 |
p. 313-319
7 p.
|
artikel
|
| 25 |
The photolysis of NO dimers, adsorbed on an MgF2 surface, at 248 nm
|
Simpson, C.J.S.M.
|
|
1996
|
250 |
3-4 |
p. 342-348
7 p.
|
artikel
|
| 26 |
The unit cell of the gallosilicate mesoporous molecular sieve [Si,Ga]-MCM-41 is significantly smaller than in the purely siliceous [Si]-MCM-41
|
Cheng, Chi-Feng
|
|
1996
|
250 |
3-4 |
p. 328-334
7 p.
|
artikel
|
| 27 |
Vacuum ultraviolet excitation of XeCl2 van der Waals complexes and small clusters
|
Dedonder-Lardeux, C.
|
|
1996
|
250 |
3-4 |
p. 293-300
8 p.
|
artikel
|
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