| nr |
titel |
auteur |
tijdschrift |
jaar |
jaarg. |
afl. |
pagina('s) |
type |
| 1 |
Ab initio molecular orbital study of excited electronic states of the vinyl radical
|
Mebel, Alexander M.
|
|
1997
|
275 |
1-2 |
p. 19-27
9 p.
|
artikel
|
| 2 |
Accurate theoretical structures of radical cations containing unusually long bonds: the structures of CH3CH2OH.+, C ̇ H 2 CH 2 O + H 2
|
Gauld, James W.
|
|
1997
|
275 |
1-2 |
p. 28-34
7 p.
|
artikel
|
| 3 |
Alternating antiferromagnetic and ferromagnetic exchange interactions in the S = 1 Heisenberg chain. Theory and magnetic properties
|
Borrás-Almenar, Juan J.
|
|
1997
|
275 |
1-2 |
p. 79-84
6 p.
|
artikel
|
| 4 |
A quantum chemical analysis of the intermolecular interactions between the molecules of the typically aprotic, dipolar acetone
|
Turi, László
|
|
1997
|
275 |
1-2 |
p. 35-39
5 p.
|
artikel
|
| 5 |
A theoretical study of the solid-state thermal isomerization reaction of methyl 4-(dimethylamino)benzenesulfonate in the energetic aspect
|
Oda, Masao
|
|
1997
|
275 |
1-2 |
p. 40-45
6 p.
|
artikel
|
| 6 |
Charge separation and exoelectron generation in collisions of sodium clusters with O2, Cl2 and C60
|
Hampe, Oliver
|
|
1997
|
275 |
1-2 |
p. 7-13
7 p.
|
artikel
|
| 7 |
Computer simulation of the orientation of lipid headgroups
|
Schneider, Klaus-Peter
|
|
1997
|
275 |
1-2 |
p. 63-69
7 p.
|
artikel
|
| 8 |
Editorial Board
|
|
|
1997
|
275 |
1-2 |
p. ii-
1 p.
|
artikel
|
| 9 |
Evidence for electron charge transfer in the polyvinylpyrrolidone-C60 system as seen from ESR spectra
|
Khairullin, Ilias I.
|
|
1997
|
275 |
1-2 |
p. 1-6
6 p.
|
artikel
|
| 10 |
Evidence of four-body contributions in the EXAFS spectrum of Na2Co[Fe(CN)6]
|
Giorgetti, Marco
|
|
1997
|
275 |
1-2 |
p. 108-112
5 p.
|
artikel
|
| 11 |
Hierarchy of counterpoise corrections for N-body clusters: generalization of the Boys-Bernardi scheme
|
Valiron, Pierre
|
|
1997
|
275 |
1-2 |
p. 46-55
10 p.
|
artikel
|
| 12 |
Interaction energies and NMR chemical shifts of noble gases in C60
|
Bühl, Michael
|
|
1997
|
275 |
1-2 |
p. 14-18
5 p.
|
artikel
|
| 13 |
Non-neutrality in a charged slit pore
|
Lee, Ming
|
|
1997
|
275 |
1-2 |
p. 56-62
7 p.
|
artikel
|
| 14 |
Ordinary and rotatory intensities for X-ray absorption at the C-1s edge of organic chiral molecules: propylene oxide and trans-1,2-dimethylcyclopropane
|
Carravetta, Vincenzo
|
|
1997
|
275 |
1-2 |
p. 70-78
9 p.
|
artikel
|
| 15 |
Picosecond excited states in poly(aryleneethynylene) s
|
Bourdin, E.
|
|
1997
|
275 |
1-2 |
p. 103-107
5 p.
|
artikel
|
| 16 |
Picosecond laser desorption kinetics of poly-(ethylene glycol)
|
Handschuh, Martin
|
|
1997
|
275 |
1-2 |
p. 93-97
5 p.
|
artikel
|
| 17 |
Probing cationic and ‘true’ Lewis acid sites in zeolite Y with NO and CO. An adsorption and EPR study
|
Seidel, A.
|
|
1997
|
275 |
1-2 |
p. 113-118
6 p.
|
artikel
|
| 18 |
Radiationless decay from the ligand-to-metal charge-transfer state in the blue copper protein plastocyanin
|
Edington, Maurice D.
|
|
1997
|
275 |
1-2 |
p. 119-126
8 p.
|
artikel
|
| 19 |
Spontaneous symmetry breaking in a NO + CO surface reaction model
|
Kortlüke, O.
|
|
1997
|
275 |
1-2 |
p. 85-92
8 p.
|
artikel
|
| 20 |
The stretching mode of deposited CO as a probe for the morphology of 5 K ices
|
Givan, A.
|
|
1997
|
275 |
1-2 |
p. 98-102
5 p.
|
artikel
|
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