| nr |
titel |
auteur |
tijdschrift |
jaar |
jaarg. |
afl. |
pagina('s) |
type |
| 1 |
Ab-initio study on low-lying states of the TiSi molecule
|
Tomonari, Mutsumi
|
|
2001
|
106 |
3 |
p. 188-193
|
artikel
|
| 2 |
A density functional theory test study on the N2··· He dimer
|
Salazar, Mary C.
|
|
2001
|
106 |
3 |
p. 218-222
|
artikel
|
| 3 |
A quantitative measure of bond polarity from the electron localization function and the theory of atoms in molecules
|
Raub, Stephan
|
|
2001
|
106 |
3 |
p. 223-232
|
artikel
|
| 4 |
A study of DNA tethered to a surface by an all-atom molecular dynamics simulation
|
Wong, Ka-Yiu
|
|
2001
|
106 |
3 |
p. 233-235
|
artikel
|
| 5 |
Electronic excitation of sulfur-organic compounds – performance of time-dependent density functional theory
|
Fabian, Jürgen
|
|
2001
|
106 |
3 |
p. 199-217
|
artikel
|
| 6 |
Hyperspherical harmonics and generalized Sturmians (Progress in theoretical chemistry and physics), John S. Avery, Kluwer, Dordrecht, 1999, ISBN 0–792–36087–7
|
Aquilanti, Vincenzo
|
|
2001
|
106 |
3 |
p. 236
|
artikel
|
| 7 |
Molecular integrals by numerical quadrature. I. Radial integration
|
Lindh, Roland
|
|
2001
|
106 |
3 |
p. 178-187
|
artikel
|
| 8 |
Study of association of 2-methoxyethanol in the aqueous phase
|
Tafazzoli, Mohsen
|
|
2001
|
106 |
3 |
p. 194-198
|
artikel
|
| 9 |
Theoretical study of silicon–sulfur clusters (SiS2)n (n = 1–6)
|
Wang, Su-Fan
|
|
2001
|
106 |
3 |
p. 163-170
|
artikel
|
| 10 |
Theoretical study of the role of low-barrier hydrogen bonds in enzyme catalysis: a model of proton transfer in serine protease
|
Kim, Yongho
|
|
2001
|
106 |
3 |
p. 171-177
|
artikel
|
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