| nr |
titel |
auteur |
tijdschrift |
jaar |
jaarg. |
afl. |
pagina('s) |
type |
| 1 |
Anharmonicity and hydrogen bonding. III. Analysis of the near infrared spectrum of water trapped in argon matrix
|
Perchard, J.P
|
|
2001
|
273 |
2-3 |
p. 217-233
17 p.
|
artikel
|
| 2 |
Author index
|
|
|
2001
|
273 |
2-3 |
p. 249-251
3 p.
|
artikel
|
| 3 |
Calculation of non-fundamental IR frequencies and intensities at the anharmonic level. I. The overtone, combination and difference bands of diazomethane, H2CN2
|
Baraille, I
|
|
2001
|
273 |
2-3 |
p. 91-101
11 p.
|
artikel
|
| 4 |
Central atom 1s photoabsorption spectra of nitrogen and phosphorus AX3 (A=N, P and X=F, H) molecules
|
Jürgensen, Astrid
|
|
2001
|
273 |
2-3 |
p. 77-89
13 p.
|
artikel
|
| 5 |
Comparison of semiclassical methods for time dependent density evolution for a two state model problem
|
Herman, Michael F.
|
|
2001
|
273 |
2-3 |
p. 175-189
15 p.
|
artikel
|
| 6 |
Coupling between lattice and intramolecular modes in 9,10-dimethylanthracene: Raman spectra under pressure and quasi-harmonic lattice dynamics calculations
|
Della Valle, Raffaele Guido
|
|
2001
|
273 |
2-3 |
p. 197-206
10 p.
|
artikel
|
| 7 |
Effects of the transition dipole moment function on the dynamics of ozone photodissociation: an exact 3D quantum mechanical study
|
Lin, Shi Ying
|
|
2001
|
273 |
2-3 |
p. 169-174
6 p.
|
artikel
|
| 8 |
Electron correlation and basis set effects on strong hydrogen bond behavior: a case study of the hydrogen difluoride anion
|
Kawahara, Shun-ichi
|
|
2001
|
273 |
2-3 |
p. 207-216
10 p.
|
artikel
|
| 9 |
Four-component relativistic calculations on the complexes between a water molecule and trivalent lanthanoid and actinoid ions
|
Mochizuki, Yuji
|
|
2001
|
273 |
2-3 |
p. 135-148
14 p.
|
artikel
|
| 10 |
π–σ* hyperconjugation mechanism on methyl rotation in cationic state of substituted toluenes
|
Kawai, Masaaki
|
|
2001
|
273 |
2-3 |
p. 191-196
6 p.
|
artikel
|
| 11 |
Ionization dynamics of CF4–H2O complexes: a full dimensional ab initio trajectory study
|
Tachikawa, Hiroto
|
|
2001
|
273 |
2-3 |
p. 149-157
9 p.
|
artikel
|
| 12 |
Picosecond absorption anisotropy of polymethine and squarylium dyes in liquid and polymeric media
|
Przhonska, Olga V
|
|
2001
|
273 |
2-3 |
p. 235-248
14 p.
|
artikel
|
| 13 |
Subject index
|
|
|
2001
|
273 |
2-3 |
p. 253-259
7 p.
|
artikel
|
| 14 |
The localization/delocalization dilemma in mixed-valence systems: a theoretical investigation on the application of the photon echo technique
|
Lami, Alessandro
|
|
2001
|
273 |
2-3 |
p. 159-167
9 p.
|
artikel
|
| 15 |
Theoretical approaches of the isomerization mechanism of GaSO isomers in doublet states at density functional theory levels
|
Bu, Yuxiang
|
|
2001
|
273 |
2-3 |
p. 103-115
13 p.
|
artikel
|
| 16 |
Theoretical study of the photoionization shape resonances of cobaltocene and nickelocene
|
Fronzoni, G
|
|
2001
|
273 |
2-3 |
p. 117-133
17 p.
|
artikel
|
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