| nr |
titel |
auteur |
tijdschrift |
jaar |
jaarg. |
afl. |
pagina('s) |
type |
| 1 |
Ab initio and DFT studies for accurate description of van der Waals interaction between He atoms
|
Kurita, Noriyuki
|
|
2001
|
348 |
1-2 |
p. 139-146
8 p.
|
artikel
|
| 2 |
Ab initio study of ammonia adsorption states on an ice surface I: structures, adsorption energies and linear dependences on coverage ratio
|
Hara, Y.
|
|
2001
|
348 |
1-2 |
p. 107-114
8 p.
|
artikel
|
| 3 |
Ab initio study of energies, structures and vibrational spectra of the complexes of water with carbon oxysulfide and nitrous oxide
|
Wójcik, Marek J.
|
|
2001
|
348 |
1-2 |
p. 126-130
5 p.
|
artikel
|
| 4 |
A model of VDAC structural rearrangement in the presence of a salt activity gradient
|
Levadny, Victor
|
|
2001
|
348 |
1-2 |
p. 102-106
5 p.
|
artikel
|
| 5 |
An accurate interaction potential for neon dimer (Ne2)
|
Gdanitz, Robert J.
|
|
2001
|
348 |
1-2 |
p. 67-74
8 p.
|
artikel
|
| 6 |
Charge polarization with large amplitude hydrogen motion of pyrazinyl radical: implication for the diffusion dynamics
|
Morita, Akihiro
|
|
2001
|
348 |
1-2 |
p. 155-159
5 p.
|
artikel
|
| 7 |
Conformations of a long molecular wire with legs on a Cu(100) surface
|
Zambelli, T.
|
|
2001
|
348 |
1-2 |
p. 1-6
6 p.
|
artikel
|
| 8 |
Dispersed fluorescence studies of linear LiOLi: a strongly bound, but very `floppy' ionic molecule
|
Bellert, D.
|
|
2001
|
348 |
1-2 |
p. 39-46
8 p.
|
artikel
|
| 9 |
Dispersive geminate recombination in a conjugated polymer
|
Nikitenko, V.R.
|
|
2001
|
348 |
1-2 |
p. 89-94
6 p.
|
artikel
|
| 10 |
Electrodeposition of diamond-like carbon films in organic solvents using a thin wire anode
|
Wang, Hao
|
|
2001
|
348 |
1-2 |
p. 7-10
4 p.
|
artikel
|
| 11 |
Experimental evidence of a single nano-graphene
|
Affoune, A.M
|
|
2001
|
348 |
1-2 |
p. 17-20
4 p.
|
artikel
|
| 12 |
Hartree–Fock geometry optimisation of periodic systems with the Crystal code
|
Civalleri, B.
|
|
2001
|
348 |
1-2 |
p. 131-138
8 p.
|
artikel
|
| 13 |
Kinetics of C2H radical reactions with ethene, propene and 1-butene measured in a pulsed Laval nozzle apparatus at T=103 and 296 K
|
Vakhtin, Andrei B.
|
|
2001
|
348 |
1-2 |
p. 21-26
6 p.
|
artikel
|
| 14 |
m-Benzyne and bicyclo[3.1.0]hexatriene – which isomer is more stable? – a quantum chemical investigation
|
Kraka, Elfi
|
|
2001
|
348 |
1-2 |
p. 115-125
11 p.
|
artikel
|
| 15 |
On the qualitative theoretical NMR chemical shifts of model carbyne catenanes and knots
|
Dobrowolski, Jan Cz.
|
|
2001
|
348 |
1-2 |
p. 60-66
7 p.
|
artikel
|
| 16 |
Polydisperse Au nanoclusters on silicon: fractal aggregates via spinodal decomposition?
|
Taylor, M.D.R
|
|
2001
|
348 |
1-2 |
p. 27-33
7 p.
|
artikel
|
| 17 |
Product energy distributions for the four-center HF elimination from 1,1-difluoroethylene. A direct dynamics study
|
Martı́nez-Núñez, Emilio
|
|
2001
|
348 |
1-2 |
p. 81-88
8 p.
|
artikel
|
| 18 |
Quantum chemical calculations on FXeSiF
|
Lundell, Jan
|
|
2001
|
348 |
1-2 |
p. 147-154
8 p.
|
artikel
|
| 19 |
RISM-SCF study for the rate constant of S N 2 reaction CH3Cl+Cl− in aqueous solution
|
Ohmiya, Kazuhiro
|
|
2001
|
348 |
1-2 |
p. 75-80
6 p.
|
artikel
|
| 20 |
Spectroscopic study of the lowest energy triplet states of 2-methyl furan
|
Giuliani, A
|
|
2001
|
348 |
1-2 |
p. 34-38
5 p.
|
artikel
|
| 21 |
Theoretical study on gas-phase proton transfer reactions between π-proton-donor and π-acceptor systems
|
Qu, Zheng-wang
|
|
2001
|
348 |
1-2 |
p. 95-101
7 p.
|
artikel
|
| 22 |
The spectral properties of the 1 S 0 state in SrAl12O19:Pr
|
Huang, Shihua
|
|
2001
|
348 |
1-2 |
p. 11-16
6 p.
|
artikel
|
| 23 |
Vibrational constants and binding energies of Sr+Xe
|
Massaouti, Maria
|
|
2001
|
348 |
1-2 |
p. 47-52
6 p.
|
artikel
|
| 24 |
Zeeman quantum beat observed by IR–UV double resonance LIF spectroscopy of acetylene in the A ̃ 1 A u 3ν3 ′+ν6 ′ and 3ν 3 ′+ν 4 ′ ungerade vibrational states
|
Yamakita, Nami
|
|
2001
|
348 |
1-2 |
p. 53-59
7 p.
|
artikel
|
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