| nr |
titel |
auteur |
tijdschrift |
jaar |
jaarg. |
afl. |
pagina('s) |
type |
| 1 |
An efficient treatment of kinematic factors in pseudo-relativistic calculations of electronic structure
|
Sjøvoll, Merethe
|
|
1998
|
99 |
1 |
p. 1-7
|
artikel
|
| 2 |
First principles calculation of the thermodynamic properties of silicon clusters
|
Dean, David W.
|
|
1998
|
99 |
1 |
p. 18-28
|
artikel
|
| 3 |
Hydrogen bonding and dissociation effects on the gas phase proton transfer reactions of ozone
|
Contreras, R.
|
|
1998
|
99 |
1 |
p. 60-63
|
artikel
|
| 4 |
On the validity of the counterpoise correction for the basis set superposition error including the fragment relaxation terms
|
Rayón, V. M.
|
|
1998
|
99 |
1 |
p. 68-70
|
artikel
|
| 5 |
Optimization of virtual orbitals in the framework of a multiconfiguration spin-coupled wave function
|
Clarke, Nick J.
|
|
1998
|
99 |
1 |
p. 8-17
|
artikel
|
| 6 |
Perturbation calculation of the interaction energy using orthogonalized orbitals
|
Laurinc, Viliam
|
|
1998
|
99 |
1 |
p. 53-59
|
artikel
|
| 7 |
Second-order quantum similarity measures from intracule and extracule densities
|
Fradera, Xavier
|
|
1998
|
99 |
1 |
p. 44-52
|
artikel
|
| 8 |
Spin-coupled calculations based on projected spin eigenfunctions
|
Friis-Jensen, Britt
|
|
1998
|
99 |
1 |
p. 64-67
|
artikel
|
| 9 |
Variation of surface partition in GEPOL: effects on solvation free energy and free-energy profiles
|
Pomelli, Christian S.
|
|
1998
|
99 |
1 |
p. 34-43
|
artikel
|
| 10 |
Why are buckyonions round?
|
Bates, Kevin R.
|
|
1998
|
99 |
1 |
p. 29-33
|
artikel
|
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