| nr |
titel |
auteur |
tijdschrift |
jaar |
jaarg. |
afl. |
pagina('s) |
type |
| 1 |
Ab initio dynamics of the He + H+2 → HeH+ +H reaction: a new potential energy surface and quantum mechanical cross-sections
|
PALMIERI, P.
|
|
2000
|
98 |
21 |
p. 1835-1849
|
artikel
|
| 2 |
A density functional study of plutonyl trifluoroacetone complexes in the gas phase and in solution
|
GAGLIARDI, LAURA
|
|
2000
|
98 |
21 |
p. 1803-1809
|
artikel
|
| 3 |
A graphical scheme for addressing determinants in large configuration interaction treatments
|
SARMA, C.R.
|
|
2000
|
98 |
21 |
p. 1851-1856
|
artikel
|
| 4 |
Analyses of the semi-classical wavepacket approach to chemical reactions: the F + H2 → HF + H reaction
|
MARKOVIC, NIKOLA
|
|
2000
|
98 |
21 |
p. 1771-1781
|
artikel
|
| 5 |
Application of a time-dependent Hartree approach on several surfaces to the vibrational predissociation of Ne2I2
|
CARMONA-NOVILLO, E.
|
|
2000
|
98 |
21 |
p. 1783-1791
|
artikel
|
| 6 |
Collective hyperspherical coordinates for polyatomic molecules and clusters
|
AQUILANTI, VINCENZO
|
|
2000
|
98 |
21 |
p. 1763-1770
|
artikel
|
| 7 |
Coupling by charge transfer: role in bond stabilization for open-shell systems and ionic molecules and in harpooning and proton attachment processes
|
PIRANI, F.
|
|
2000
|
98 |
21 |
p. 1749-1762
|
artikel
|
| 8 |
Critical analysis of the Colle-Salvetti model for electron correlation in closed shell systems: pair correlations
|
CARATZOULAS, S.
|
|
2000
|
98 |
21 |
p. 1811-1821
|
artikel
|
| 9 |
Introduction to the TMR Network: potential energy surfaces for molecular spectroscopy and dynamics
|
PALMIERI, PAOLO
|
|
2000
|
98 |
21 |
p. 1673-1675
|
artikel
|
| 10 |
Numerical techniques for the evaluation of non-adiabatic interactions and the generation of quasi-diabatic potential energy surfaces using configuration interaction methods
|
MITRUSHENKOV, ALEXANDER O.
|
|
2000
|
98 |
21 |
p. 1677-1690
|
artikel
|
| 11 |
Spin-orbit matrix elements for internally contracted multireference configuration interaction wavefunctions
|
BERNING, ANDREAS
|
|
2000
|
98 |
21 |
p. 1823-1833
|
artikel
|
| 12 |
The ion-molecule reaction O+ (4S) + N2(X1Σ+) → NO+ (X1Σ +, v') + N(4S) and the predissociation of the A2Σ+ and B2Π states of N2O+
|
CHAMBAUD, G.
|
|
2000
|
98 |
21 |
p. 1793-1802
|
artikel
|
| 13 |
Vibrational-rotational energy transfer in H2-H2 collisions: III. Ortho-ortho collisions
|
ZENEVICH, VLADIMIR A.
|
|
2000
|
98 |
21 |
p. 1691-1695
|
artikel
|
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