nr |
titel |
auteur |
tijdschrift |
jaar |
jaarg. |
afl. |
pagina('s) |
type |
1 |
Accurate calculation of core-electron binding energies by the density-functional method
|
Chong, Delano P. |
|
1995 |
232 |
5-6 |
p. 486-490 5 p. |
artikel |
2 |
A distributed electrostatic model for field gradients at nuclei in van der Waals molecules: application to complexes of HCl
|
Buckingham, A.D. |
|
1995 |
232 |
5-6 |
p. 437-444 8 p. |
artikel |
3 |
Author index to volume 232
|
|
|
1995 |
232 |
5-6 |
p. 587-596 10 p. |
artikel |
4 |
CASSCF calculations of the multipole moments and dipole polarisability functions of the X 2Σ+ and A 2Π states of CO+
|
Martin, P.A. |
|
1995 |
232 |
5-6 |
p. 491-496 6 p. |
artikel |
5 |
Characterization of luminous beams from laser ablation by imaging techniques
|
Chen, Kuo-mei |
|
1995 |
232 |
5-6 |
p. 576-580 5 p. |
artikel |
6 |
Current density investigation of tunneling in photodissociation resonances: CH3ONO
|
Miller, Steven M. |
|
1995 |
232 |
5-6 |
p. 451-456 6 p. |
artikel |
7 |
Dissociative photoexcitation of CH4 and CD4
|
Sorensen, S.L. |
|
1995 |
232 |
5-6 |
p. 554-560 7 p. |
artikel |
8 |
Electronic and geometrical structure of H2BOBH2. An ab initio study
|
Gatti, Fabien |
|
1995 |
232 |
5-6 |
p. 503-508 6 p. |
artikel |
9 |
Elimination of asymptotic couplings in molecular dynamics
|
Riera, A. |
|
1995 |
232 |
5-6 |
p. 457-462 6 p. |
artikel |
10 |
Evaluation of hyperfine coupling tensors of the BeH and BeF radicals
|
Fernandez, Berta |
|
1995 |
232 |
5-6 |
p. 463-471 9 p. |
artikel |
11 |
Force field parametrization by weak coupling. Re-engineering SPC water
|
Berweger, Christian D. |
|
1995 |
232 |
5-6 |
p. 429-436 8 p. |
artikel |
12 |
Formation of SiF2 in the infrared multiphoton decomposition of Si2F6 and the reactions of SiF2 with Br2, NO2 and C2H4
|
Sugawara, Ko-ichi |
|
1995 |
232 |
5-6 |
p. 561-566 6 p. |
artikel |
13 |
Graph theoretical perception of molecular symmetry
|
Balasubramanian, K. |
|
1995 |
232 |
5-6 |
p. 415-423 9 p. |
artikel |
14 |
Induced pair polarizability anisotropy in mercury from depolarized interaction-induced light scattering spectra
|
Barocchi, F. |
|
1995 |
232 |
5-6 |
p. 445-450 6 p. |
artikel |
15 |
Location of an O atom in the Pd(110)c(2×4)-O structure. An EELS study
|
Takagi, N. |
|
1995 |
232 |
5-6 |
p. 531-536 6 p. |
artikel |
16 |
Low-temperature ESR studies on the photolysis of nitrosyl haemoglobin in aqueous solutions
|
Plonka, Andrzej |
|
1995 |
232 |
5-6 |
p. 581-586 6 p. |
artikel |
17 |
Monte Carlo simulations of M+Cl− (H2O) n (M = Li, Na) clusters and the dissolving mechanism of ion pairs in water
|
Asada, T. |
|
1995 |
232 |
5-6 |
p. 518-523 6 p. |
artikel |
18 |
Observation of an sp-derived surface resonance on Pt(111) indicating the crucial role of surface states in physisorption
|
Roos, P. |
|
1995 |
232 |
5-6 |
p. 537-541 5 p. |
artikel |
19 |
Rotational energy transfer in collisions between CN (X, ν = 2) and argon. Comparison with results for helium
|
Fei, R. |
|
1995 |
232 |
5-6 |
p. 547-553 7 p. |
artikel |
20 |
Rotational resonance in the tilted rotating frame
|
Takegoshi, K. |
|
1995 |
232 |
5-6 |
p. 424-428 5 p. |
artikel |
21 |
The effect of hydration on the molecular charge distribution of cations. An ab initio SCRF study
|
Luque, F.J. |
|
1995 |
232 |
5-6 |
p. 509-517 9 p. |
artikel |
22 |
The indirect channel to hydrogen dissociation on W(100)-c(2×2)Cu. Evidence for a dynamical precursor
|
Butler, D.A. |
|
1995 |
232 |
5-6 |
p. 542-546 5 p. |
artikel |
23 |
Theoretical calculations of proton affinities in phenol
|
Eckert-Maksić, M. |
|
1995 |
232 |
5-6 |
p. 472-478 7 p. |
artikel |
24 |
The radical anions of silyl-substituted pyrenes and silyl-bridged dipyrenes
|
Gherghel, L. |
|
1995 |
232 |
5-6 |
p. 567-570 4 p. |
artikel |
25 |
Time-dependent Monte Carlo simulations of radical densities and distributions on the diamond {001} (2 × 1): H surface
|
Dawnkaski, E.J. |
|
1995 |
232 |
5-6 |
p. 524-530 7 p. |
artikel |
26 |
Vibrational states of LiCN calculated from an ab initio potential energy surface
|
Makarewicz, J. |
|
1995 |
232 |
5-6 |
p. 497-502 6 p. |
artikel |
27 |
Vibronic intensities in the optical absorption spectra of Pr3+ in Cs2NaPr x Y1−x Cl6: concentration and temperature dependence
|
Luxbacher, Thomas |
|
1995 |
232 |
5-6 |
p. 571-575 5 p. |
artikel |
28 |
Weak intermolecular interactions between nitrogen and oxygen atoms
|
Platts, J.A. |
|
1995 |
232 |
5-6 |
p. 479-485 7 p. |
artikel |