| nr |
titel |
auteur |
tijdschrift |
jaar |
jaarg. |
afl. |
pagina('s) |
type |
| 1 |
Ab initio calculation of the intermolecular potential energy surface of (CO2)2 and first applications in simulations of fluid CO2
|
Welker, Marc
|
|
1996
|
213 |
1-3 |
p. 253-261
9 p.
|
artikel
|
| 2 |
Ab initio study of unimolecular pyrolysis mechanisms of dithioformic acid
|
Xie, Xiaoguang
|
|
1996
|
213 |
1-3 |
p. 133-137
5 p.
|
artikel
|
| 3 |
A critical analysis of the two-dimensional atom ellipsoid model to study rotational collisions
|
Belchior, J.C.
|
|
1996
|
213 |
1-3 |
p. 303-311
9 p.
|
artikel
|
| 4 |
A method to calculate the probability distribution for systems with large energy barriers
|
Engkvist, Ola
|
|
1996
|
213 |
1-3 |
p. 63-76
14 p.
|
artikel
|
| 5 |
An ab initio study of the potential energy surface in the S1 state of 2-hydroxypyridine
|
Sobolewski, Andrzej L.
|
|
1996
|
213 |
1-3 |
p. 193-201
9 p.
|
artikel
|
| 6 |
Analysis of polarization effects in time-dependent Rayleigh light scattering by optically active molecules
|
Knast, Krzysztof
|
|
1996
|
213 |
1-3 |
p. 465-482
18 p.
|
artikel
|
| 7 |
A new method of calculating exponential operators for scattering problems
|
Storozhev, A.V.
|
|
1996
|
213 |
1-3 |
p. 313-318
6 p.
|
artikel
|
| 8 |
An IPA procedure for bound-continuum diatomic transition intensities
|
Ivanov, V.S.
|
|
1996
|
213 |
1-3 |
p. 295-301
7 p.
|
artikel
|
| 9 |
Author index to volume 213
|
|
|
1996
|
213 |
1-3 |
p. 489-493
5 p.
|
artikel
|
| 10 |
Calculation of magnetizabilities using GIAO current density distributions
|
Keith, Todd A.
|
|
1996
|
213 |
1-3 |
p. 123-132
10 p.
|
artikel
|
| 11 |
Calculations on ground and excited state potential energy surfaces of floppy free radicals: HC4H2, HC3NH, and HC3O
|
Wang, H.
|
|
1996
|
213 |
1-3 |
p. 139-151
13 p.
|
artikel
|
| 12 |
Conformational studies of cyclopropylcarbonyl fluoride from temperature dependent FT-IR spectra of xenon solutions
|
Durig, J.R.
|
|
1996
|
213 |
1-3 |
p. 165-179
15 p.
|
artikel
|
| 13 |
Conformational studies of propenoyl chloride in liquid xenon from temperature dependent FT-IR spectra
|
Durig, J.R.
|
|
1996
|
213 |
1-3 |
p. 181-192
12 p.
|
artikel
|
| 14 |
Correlation effects in the long-range coupling between acetylenic π-electrons in a series of α,ω-diethynyl[n]staffanes (n = 1–5)
|
Braga, Manuel
|
|
1996
|
213 |
1-3 |
p. 159-164
6 p.
|
artikel
|
| 15 |
Dissociative excitation of CH4 by electron impact: Emission cross sections for the fragment species
|
Motohashi, K.
|
|
1996
|
213 |
1-3 |
p. 369-384
16 p.
|
artikel
|
| 16 |
Dynamical symmetry in the vibrational overtone spectrum of monofluoroacetylene (HCCF)
|
Bernardes, E.S.
|
|
1996
|
213 |
1-3 |
p. 17-32
16 p.
|
artikel
|
| 17 |
Editorial Board
|
|
|
1996
|
213 |
1-3 |
p. ii-
1 p.
|
artikel
|
| 18 |
Effect of ethanol addition upon the structure and the cooperativity of the water H bond network
|
Lamanna, R.
|
|
1996
|
213 |
1-3 |
p. 95-110
16 p.
|
artikel
|
| 19 |
Electric permittivity in the one- and two-phase region of 1-nitropropane-hexadecane near-critical solution
|
Paluch, M.
|
|
1996
|
213 |
1-3 |
p. 483-488
6 p.
|
artikel
|
| 20 |
Exciton scattering, κ selection rule, exciton bandwidth in pyrene microcrystallites, and lattice relaxation energy for the origin of V luminescence
|
Oeda, Y.
|
|
1996
|
213 |
1-3 |
p. 421-427
7 p.
|
artikel
|
| 21 |
Exploratory Pariser-Parr-Pople investigation of the static first hyperpolarizability of polymethineimine chains
|
Jacquemin, Denis
|
|
1996
|
213 |
1-3 |
p. 217-228
12 p.
|
artikel
|
| 22 |
Fast translational thermalization of extreme disequilibrium induced by cluster impact
|
Raz, T.
|
|
1996
|
213 |
1-3 |
p. 263-275
13 p.
|
artikel
|
| 23 |
High-resolution threshold photoelectron spectroscopy of molecular fluorine
|
Cormack, A.J.
|
|
1996
|
213 |
1-3 |
p. 439-448
10 p.
|
artikel
|
| 24 |
Influence of pressure on the ferroelectric phase transition in a symmetrical polymerizable diacetylene crystal DNP
|
Even, J.
|
|
1996
|
213 |
1-3 |
p. 357-363
7 p.
|
artikel
|
| 25 |
Influence of the molecular environment on the hyperfine interaction of 111Cd ions in gaseous radioactive indium halides
|
Ruth, C.
|
|
1996
|
213 |
1-3 |
p. 459-464
6 p.
|
artikel
|
| 26 |
Interatonic potentials for XO+ and B31 states of intercombination cadmium line 326.1 nm broadened by Ar pressure
|
Roston, G.D.
|
|
1996
|
213 |
1-3 |
p. 365-368
4 p.
|
artikel
|
| 27 |
IR induced isomerisation of HDO complexes: a method for the observation of FIR spectra of matrix isolated water complexes
|
Engdahl, Anders
|
|
1996
|
213 |
1-3 |
p. 333-339
7 p.
|
artikel
|
| 28 |
Laser-induced fluorescence excitation spectroscopy of jet-cooled tropolone-carbon monoxide van der Waals complexes
|
Sinha, Hemant K.
|
|
1996
|
213 |
1-3 |
p. 397-411
15 p.
|
artikel
|
| 29 |
Modeling of optical pumping experiments in CO. I. Time-resolved experiments
|
Porshnev, Pete I.
|
|
1996
|
213 |
1-3 |
p. 111-122
12 p.
|
artikel
|
| 30 |
Molecular dynamics simulations of water/metal and water/vacuum interfaces with a polarizable water model
|
Kohlmeyer, Axel
|
|
1996
|
213 |
1-3 |
p. 211-216
6 p.
|
artikel
|
| 31 |
Molecular dynamics study of infinitely dilute aqueous solutions of small biological molecules. Calculation of the static and dynamic properties of formaldehyde
|
Tolosa, S.
|
|
1996
|
213 |
1-3 |
p. 203-210
8 p.
|
artikel
|
| 32 |
On the sampling of microcanonical distribution for rotating triatomic molecules
|
Rosenblum, I.
|
|
1996
|
213 |
1-3 |
p. 243-252
10 p.
|
artikel
|
| 33 |
Optically pumped laser emission in K2 involving rovibrational levels near the B 1 Π u state dissociation limit
|
Clark, B.K.
|
|
1996
|
213 |
1-3 |
p. 229-241
13 p.
|
artikel
|
| 34 |
Photodissociation dynamics of HN3(DN3) + hv → H(D)+ N3
|
Lock, Michael
|
|
1996
|
213 |
1-3 |
p. 385-396
12 p.
|
artikel
|
| 35 |
Positronium dynamics in aqueous solutions of ionic surfactants
|
Consolati, G.
|
|
1996
|
213 |
1-3 |
p. 449-457
9 p.
|
artikel
|
| 36 |
Preferential solvation study: Solvation of sodium chloride in water-hydroxylamine mixtures
|
Vizoso, Sergi
|
|
1996
|
213 |
1-3 |
p. 77-93
17 p.
|
artikel
|
| 37 |
Rotational relaxation of nitrogen in helium
|
Belikov, Andrey E.
|
|
1996
|
213 |
1-3 |
p. 319-331
13 p.
|
artikel
|
| 38 |
Second harmonic generation in partially ordered media and at interfaces: analysis of dynamical and orientational factors
|
Andrews, David L.
|
|
1996
|
213 |
1-3 |
p. 277-294
18 p.
|
artikel
|
| 39 |
Spin-spin interactions in the reduced [Fe6S6]5+ cluster
|
Czerwiński, M.
|
|
1996
|
213 |
1-3 |
p. 45-62
18 p.
|
artikel
|
| 40 |
Subject index to volume 213
|
|
|
1996
|
213 |
1-3 |
p. 495-506
12 p.
|
artikel
|
| 41 |
The ArClF Van der Waals complex as an example of how atoms inside a molecule interact with those outside
|
Naumkin, F.Y.
|
|
1996
|
213 |
1-3 |
p. 33-43
11 p.
|
artikel
|
| 42 |
The photochemical reaction of excited acetophenone and benzaldehyde in the gas phase
|
Matsushita, Yoshihisa
|
|
1996
|
213 |
1-3 |
p. 413-419
7 p.
|
artikel
|
| 43 |
The use of locally dense basis sets in correlated NMR chemical shielding calculations
|
Chesnut, D.B.
|
|
1996
|
213 |
1-3 |
p. 153-158
6 p.
|
artikel
|
| 44 |
Time-resolved spectroscopy of wild-type and mutant Green Fluorescent Proteins reveals excited state deprotonation consistent with fluorophore-protein interactions
|
Lossau, H.
|
|
1996
|
213 |
1-3 |
p. 1-16
16 p.
|
artikel
|
| 45 |
Triplet quantum yield determination by picosecond laser double-pulse fluorescence excitation
|
Reindl, S.
|
|
1996
|
213 |
1-3 |
p. 429-438
10 p.
|
artikel
|
| 46 |
Vibrational dephasing in bromocyclohexane: how to separate contributions from different mechanisms
|
Kolodziejski, M.
|
|
1996
|
213 |
1-3 |
p. 341-356
16 p.
|
artikel
|
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