| nr |
titel |
auteur |
tijdschrift |
jaar |
jaarg. |
afl. |
pagina('s) |
type |
| 1 |
Ab initio structure calculations of hydrogen ionic clusters
|
Farizon, M.
|
|
1991
|
177 |
4-5 |
p. 451-457
7 p.
|
artikel
|
| 2 |
An ab initio study of the stationary structures of the major gas-phase tautomer of adenine
|
Riggs, Noel V.
|
|
1991
|
177 |
4-5 |
p. 447-450
4 p.
|
artikel
|
| 3 |
Benzyne: higher-level theoretical evidence for the weak triple bond
|
Scheiner, Andrew C.
|
|
1991
|
177 |
4-5 |
p. 471-476
6 p.
|
artikel
|
| 4 |
Comparison of ab initio and experimentally determined torsional potentials of ethylene in the ground state
|
Sebastian, Rudy
|
|
1991
|
177 |
4-5 |
p. 404-406
3 p.
|
artikel
|
| 5 |
Comparison of the structure and dynamics of water at the Pt(111) and Pt(100) interfaces: molecular dynamics study
|
Raghavan, K.
|
|
1991
|
177 |
4-5 |
p. 426-432
7 p.
|
artikel
|
| 6 |
Concentration dependence of fading of the open form of 6′-nitroindolinospiropyran in a polymer matrix
|
Drabe, Karel E.
|
|
1991
|
177 |
4-5 |
p. 399-403
5 p.
|
artikel
|
| 7 |
Correlation energies in the isoelectronic series of He, Li, Be and Ne
|
Rizzo, Antonio
|
|
1991
|
177 |
4-5 |
p. 477-482
6 p.
|
artikel
|
| 8 |
Does oxirene exist? A theoretical inquiry involving the coupled-cluster method
|
Vacek, George
|
|
1991
|
177 |
4-5 |
p. 468-470
3 p.
|
artikel
|
| 9 |
Efficient and stable method of searching for optimum structures of molecules containing cyclic parts
|
Nakano, Haruyuki
|
|
1991
|
177 |
4-5 |
p. 458-462
5 p.
|
artikel
|
| 10 |
Free energy evaluation from molecular dynamics simulations using force fields including electronics polarization
|
Straatsma, T.P.
|
|
1991
|
177 |
4-5 |
p. 433-440
8 p.
|
artikel
|
| 11 |
Improved potential energy curves and dissociation energies for HF, DF and TF
|
Zemke, Warren T.
|
|
1991
|
177 |
4-5 |
p. 412-418
7 p.
|
artikel
|
| 12 |
Interaction energies associated with short intermolecular contacts of C—H bonds. Structure and energetics of the interaction between CH4 and CN−
|
Novoa, Juan J.
|
|
1991
|
177 |
4-5 |
p. 483-490
8 p.
|
artikel
|
| 13 |
Microsolvation of the benzene molecule by argon atoms: spectroscopy and isomers
|
Schmidt, Martin
|
|
1991
|
177 |
4-5 |
p. 371-379
9 p.
|
artikel
|
| 14 |
Molecular applications of size-extensive quasi-Hilbert- and quasi-Fock-space coupled-cluster formalisms using incomplete model spaces
|
Mukhopadhyay Jr., Debasis
|
|
1991
|
177 |
4-5 |
p. 441-446
6 p.
|
artikel
|
| 15 |
Photoelectrons from negative dimers and clusters of sulfur dioxide
|
Dresch, T.
|
|
1991
|
177 |
4-5 |
p. 383-388
6 p.
|
artikel
|
| 16 |
Preparation and UV / visible spectra of fullerenes C60 and C70
|
Hare, J.P.
|
|
1991
|
177 |
4-5 |
p. 394-398
5 p.
|
artikel
|
| 17 |
Recombination of N+ 4 and N+ 3 with electrons in atmospheric pressure nitrogen
|
Ikezoe, Yasumasa
|
|
1991
|
177 |
4-5 |
p. 366-370
5 p.
|
artikel
|
| 18 |
Rotational assignments in the S1 (1B3 u) state of pyrazine by UV – UV pump-probe laser spectroscopy
|
de Haag, Paul Uijt
|
|
1991
|
177 |
4-5 |
p. 357-360
4 p.
|
artikel
|
| 19 |
Simulation of LEED patterns from complex surface structures
|
Panagiotides, N.
|
|
1991
|
177 |
4-5 |
p. 419-425
7 p.
|
artikel
|
| 20 |
Site-selection spectroscopy of poly(di-n-butylgermylene) (PDBG)
|
Mahrt, R.F.
|
|
1991
|
177 |
4-5 |
p. 389-393
5 p.
|
artikel
|
| 21 |
Spectroscopically determined binding energies of CrAr+ and Cr(N2)+
|
Lessen, D.E.
|
|
1991
|
177 |
4-5 |
p. 380-382
3 p.
|
artikel
|
| 22 |
The fluorine effect on the circular dichroism: ab initio CI study of the optical rotatory strengths in fluoro- and methyl-cyclopropanone
|
Ha, Tae-Kyu
|
|
1991
|
177 |
4-5 |
p. 463-467
5 p.
|
artikel
|
| 23 |
Time resolved study of vibrational relaxation in solid CO2 at high pressures
|
Baggen, Michael
|
|
1991
|
177 |
4-5 |
p. 361-365
5 p.
|
artikel
|
| 24 |
What is the nature of the ligand-bond-involving vibronic transitions in lanthanide (III) complexes?
|
Strȩk, W.
|
|
1991
|
177 |
4-5 |
p. 407-411
5 p.
|
artikel
|
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