nr |
titel |
auteur |
tijdschrift |
jaar |
jaarg. |
afl. |
pagina('s) |
type |
1 |
Absorption spectra of small silver clusters Ag n (n⩾3)
|
Rabin, I. |
|
1999 |
312 |
5-6 |
p. 394-398 5 p. |
artikel |
2 |
Accurately solving the electronic Schrödinger equation of atoms and molecules using explicitly correlated (r 12-)MR-CI.
|
Gdanitz, Robert J. |
|
1999 |
312 |
5-6 |
p. 578-584 7 p. |
artikel |
3 |
An ab initio study of DNA base pair hydrogen bonding: a comparison of plane-wave versus Gaussian-type function methods
|
Fellers, R.S |
|
1999 |
312 |
5-6 |
p. 548-555 8 p. |
artikel |
4 |
An adiabatic picture for electron transfer in mixed-valence systems 1 This Letter is dedicated to Professor Kent Wilson. 1
|
Cao, Jianshu |
|
1999 |
312 |
5-6 |
p. 606-612 7 p. |
artikel |
5 |
An application of the rotating line umbrella model to quantum dynamics of S N 2 reactions
|
Yu, Hua-Gen |
|
1999 |
312 |
5-6 |
p. 585-590 6 p. |
artikel |
6 |
Angular geometry, binding strength and charge transfer for the complex H2S⋯ICl determined by rotational spectroscopy
|
Legon, A.C. |
|
1999 |
312 |
5-6 |
p. 385-393 9 p. |
artikel |
7 |
A theoretical base for optimising intermolecular interactions driving polarity formation in channel-type host–guest materials
|
Quintel, Andrea |
|
1999 |
312 |
5-6 |
p. 567-571 5 p. |
artikel |
8 |
A tier model calculation of the absorption spectrum of the fourth CH stretch overtone state CH(v=5) in benzene
|
Rashev, S. |
|
1999 |
312 |
5-6 |
p. 561-566 6 p. |
artikel |
9 |
Connectivity polynomial and long-range contributions in the molecular connectivity model
|
Estrada, Ernesto |
|
1999 |
312 |
5-6 |
p. 556-560 5 p. |
artikel |
10 |
Decomposition of exchange-correlation energies
|
Gilbert, Andrew T.B. |
|
1999 |
312 |
5-6 |
p. 511-521 11 p. |
artikel |
11 |
Erratum
|
|
|
1999 |
312 |
5-6 |
p. 617- 1 p. |
artikel |
12 |
Erratum
|
|
|
1999 |
312 |
5-6 |
p. 613-616 4 p. |
artikel |
13 |
Exposure mechanism of fullerene derivative electron beam resists
|
Robinson, A.P.G |
|
1999 |
312 |
5-6 |
p. 469-474 6 p. |
artikel |
14 |
Femtosecond dynamics of ground-state vibrational motion and energy flow: polymers of diacetylene
|
Vierheilig, A |
|
1999 |
312 |
5-6 |
p. 349-356 8 p. |
artikel |
15 |
Hole burning properties of aluminum phthalocyanine tetrasulphonate in water-containing poly(2-hydroxyethyl methacrylate) films
|
Hayes, J.M |
|
1999 |
312 |
5-6 |
p. 362-368 7 p. |
artikel |
16 |
Index
|
|
|
1999 |
312 |
5-6 |
p. 618-626 9 p. |
artikel |
17 |
Investigation of the solvatochromic electronic transitions of [Ru(NH3)4bipyridine]2+
|
Streiff, John H. |
|
1999 |
312 |
5-6 |
p. 369-375 7 p. |
artikel |
18 |
Magnetic-field effect on the micellar surface-bound benzophenone tetracarboxylic acid–sodium salt in aqueous cetyltrimethylammonium bromide medium
|
Haldar, Mintu |
|
1999 |
312 |
5-6 |
p. 432-439 8 p. |
artikel |
19 |
Mapping molecular dynamics (Na2) in intense laser fields: another dimension to femtochemistry
|
Frohnmeyer, T. |
|
1999 |
312 |
5-6 |
p. 447-454 8 p. |
artikel |
20 |
Measurement of the nonlinear refractive index n 2 of electronically excited terthiophene
|
Helbig, M. |
|
1999 |
312 |
5-6 |
p. 415-421 7 p. |
artikel |
21 |
Mode specific vibrational kinetics after intramolecular electron transfer studied by picosecond anti-Stokes Raman spectroscopy
|
Hogiu, S |
|
1999 |
312 |
5-6 |
p. 407-414 8 p. |
artikel |
22 |
Molecular-beam study of the adsorption and desorption of hydrogen sulfide on Ag{111}
|
Yu, Y |
|
1999 |
312 |
5-6 |
p. 455-460 6 p. |
artikel |
23 |
Non-exponential relaxation of a single quantum vibrational excitation of a large molecule in collision free gas phase at elevated temperature
|
Myers, D.J. |
|
1999 |
312 |
5-6 |
p. 399-406 8 p. |
artikel |
24 |
Optical absorptions of the X-center-type sodium nanoclusters in the gas-aggregation technique with a reactant nozzle
|
Sanekata, Masaomi |
|
1999 |
312 |
5-6 |
p. 422-431 10 p. |
artikel |
25 |
Origin of the unusual stability of MnO4 −
|
Gutsev, Gennady L |
|
1999 |
312 |
5-6 |
p. 598-605 8 p. |
artikel |
26 |
Perturbative inversion of the HOCl potential energy surface via singular value decomposition
|
Skokov, Sergei |
|
1999 |
312 |
5-6 |
p. 494-502 9 p. |
artikel |
27 |
Prediction of a nanoporous sp2-carbon framework structure by combining graph theory with quantum mechanics
|
Winkler, Björn |
|
1999 |
312 |
5-6 |
p. 536-541 6 p. |
artikel |
28 |
Quantum anharmonic frequencies of the O⋯ H⋯ O fragment of the H5O2 + ion: a model three-dimensional study
|
Vener, M.V. |
|
1999 |
312 |
5-6 |
p. 591-597 7 p. |
artikel |
29 |
Quantum dynamics of intramolecular vibrational energy redistribution for initally excited CC ring modes in 30-mode benzene
|
Minehardt, Todd J. |
|
1999 |
312 |
5-6 |
p. 485-493 9 p. |
artikel |
30 |
Rate-equation theory of azobenzene monolayer photoisomerization
|
Zhao, Wei |
|
1999 |
312 |
5-6 |
p. 572-577 6 p. |
artikel |
31 |
Resonant chaos control by light in a chemiluminescent reaction
|
Guderian, A |
|
1999 |
312 |
5-6 |
p. 440-446 7 p. |
artikel |
32 |
Rotational spectrum, structure and modeling of an isomer of the HCCH–OCS dimer
|
Peebles, Sean A |
|
1999 |
312 |
5-6 |
p. 357-361 5 p. |
artikel |
33 |
Study of correlations for dihydrogen bonds by quantum-chemical calculations
|
Grabowski, Stawomir J |
|
1999 |
312 |
5-6 |
p. 542-547 6 p. |
artikel |
34 |
Synthesis of aligned carbon nanotubes using thermal chemical vapor deposition
|
Lee, Cheol Jin |
|
1999 |
312 |
5-6 |
p. 461-468 8 p. |
artikel |
35 |
The dynamics of gain-narrowing in a ladder-type π-conjugated polymer
|
Wegmann, G. |
|
1999 |
312 |
5-6 |
p. 376-384 9 p. |
artikel |
36 |
Theoretical calculations of thermal rate constants for the N( 2 D )+acetylene reaction
|
Takayanagi, Toshiyuki |
|
1999 |
312 |
5-6 |
p. 503-510 8 p. |
artikel |
37 |
Theoretical study of vibrational spectra for Cl−(H2O): temperature dependence and the influence of Ar n (n=1–3)
|
Satoh, Katsuhiko |
|
1999 |
312 |
5-6 |
p. 522-529 8 p. |
artikel |
38 |
Toward coupled-cluster accuracy in the prediction of nuclear shielding constants: a simple and efficient DFT approach
|
Wilson, Philip J. |
|
1999 |
312 |
5-6 |
p. 475-484 10 p. |
artikel |
39 |
Vibrational–rotational energy transfer in H2–H2 collisions
|
Zenevich, Vladimir A. |
|
1999 |
312 |
5-6 |
p. 530-535 6 p. |
artikel |