nr |
titel |
auteur |
tijdschrift |
jaar |
jaarg. |
afl. |
pagina('s) |
type |
1 |
A basis set convergence study of conventional and HSF electron densities in the Li2 molecule
|
Challacombe, Matt |
|
1994 |
224 |
1-2 |
p. 179-185 7 p. |
artikel |
2 |
A comparative semi-empirical study of pyrrole and phosphole oligomers
|
Karelson, Mati |
|
1994 |
224 |
1-2 |
p. 213-218 6 p. |
artikel |
3 |
A full-CI investigation into the BSSE problem
|
Mayer, I. |
|
1994 |
224 |
1-2 |
p. 166-174 9 p. |
artikel |
4 |
Anisotropic distortion of J-aggregates at decreasing temperature
|
Daehne, L. |
|
1994 |
224 |
1-2 |
p. 91-94 4 p. |
artikel |
5 |
CIDEP measurement in the L band microwave frequency region. Hyperfine-independent versus hyperfine-dependent mechanisms in the ST_mixing of acetone in 2-propanol
|
Terazima, Masahide |
|
1994 |
224 |
1-2 |
p. 95-100 6 p. |
artikel |
6 |
Classical description of ultrafast internal conversion processes. The benzene cation
|
Stock, Gerhard |
|
1994 |
224 |
1-2 |
p. 131-138 8 p. |
artikel |
7 |
Crossed beam collisional excitation of pyrimidine from the laser-prepared T1 state into the S1 state
|
Ottinger, Ch. |
|
1994 |
224 |
1-2 |
p. 24-30 7 p. |
artikel |
8 |
Determination of the barrier height to CH3CO dissociation
|
North, Simon |
|
1994 |
224 |
1-2 |
p. 38-42 5 p. |
artikel |
9 |
Direct ionization of zeolites by far-UV light following electron trapping by charge balancing cation clusters
|
Liu, Xinsheng |
|
1994 |
224 |
1-2 |
p. 31-37 7 p. |
artikel |
10 |
Discrete UV absorption by N+ 3 (N2) n clusters
|
Friedmann, A.A. |
|
1994 |
224 |
1-2 |
p. 16-20 5 p. |
artikel |
11 |
Dynamics of laser-induced transient light scattering in pure liquids and reverse micelles
|
Chen, H.M. |
|
1994 |
224 |
1-2 |
p. 69-74 6 p. |
artikel |
12 |
Experimental determination of the effect of polarization of the heating laser pulse on the characteristic decay time constant and focal length of thermal lenses, and on the thermal diffusivities in pure liquids
|
Chen, H.M. |
|
1994 |
224 |
1-2 |
p. 61-68 8 p. |
artikel |
13 |
High-pressure molecular dynamics of a nucleic acid fragment
|
Norberg, Jan |
|
1994 |
224 |
1-2 |
p. 219-224 6 p. |
artikel |
14 |
Identification of compounds produced through contact arc vaporization of graphite under CH4 ambience
|
Tai, Y. |
|
1994 |
224 |
1-2 |
p. 118-122 5 p. |
artikel |
15 |
Nuclear cusps in the HSF electron density
|
Cioslowski, Jerzy |
|
1994 |
224 |
1-2 |
p. 175-178 4 p. |
artikel |
16 |
Particle size and pH effects on the sensitization of nanoporous titanium dioxide electrodes by Q-sized silver sulfide
|
Hoyer, P. |
|
1994 |
224 |
1-2 |
p. 75-80 6 p. |
artikel |
17 |
Photoelectrochemical reactivity of a sulfide treated p-GaAs electrode
|
Ushizaki, J. |
|
1994 |
224 |
1-2 |
p. 81-85 5 p. |
artikel |
18 |
Photoinduced polymerization of solid C70 films
|
Rao, A.M. |
|
1994 |
224 |
1-2 |
p. 106-112 7 p. |
artikel |
19 |
Potential energy surface for the ligand substitution reaction of the square-planar platinum(II) complex. Essential role of the repulsive three-body effect
|
Muguruma, Chizuru |
|
1994 |
224 |
1-2 |
p. 139-144 6 p. |
artikel |
20 |
Pressure and temperature dependence of the gas-phase reaction between methyl and hydroxyl radicals
|
Fagerström, Kjell |
|
1994 |
224 |
1-2 |
p. 43-50 8 p. |
artikel |
21 |
Rapidly converging high-precision He ground state energies through the use of systematically constructed Gaussian geminals
|
Wenzel, Klaus B. |
|
1994 |
224 |
1-2 |
p. 155-159 5 p. |
artikel |
22 |
Rydberg states of acetylene clusters (C2H2)2 and (C2H2)3 resolved by two-photon resonant ionization spectroscopy
|
Zhu, Y.F. |
|
1994 |
224 |
1-2 |
p. 7-15 9 p. |
artikel |
23 |
Second-order Møller-Plesset perturbation theory for molecular Dirac-Hartree-Fock wavefunctions. Theory for up to two open-shell electrons
|
Dyall, Kenneth G. |
|
1994 |
224 |
1-2 |
p. 186-194 9 p. |
artikel |
24 |
Slicing photofragment spatial distribution by laser sheet ionization
|
Tonokura, Kenichi |
|
1994 |
224 |
1-2 |
p. 1-6 6 p. |
artikel |
25 |
Submillimeter wave spectrum of the SH+ 3 ion. J = 2-1, K = 0 and 1 transitions
|
Lee, Sang K. |
|
1994 |
224 |
1-2 |
p. 21-23 3 p. |
artikel |
26 |
Symmetry properties of the leapfrog transformation for fullerenes and benzenoids
|
Fowler, Patrick W. |
|
1994 |
224 |
1-2 |
p. 123-130 8 p. |
artikel |
27 |
The blue up-conversion emission of glass ceramics doped with Er3+ ion upon green line (19436 cm−1) excitation
|
Xu, W. |
|
1994 |
224 |
1-2 |
p. 56-60 5 p. |
artikel |
28 |
The circular dichroism spectrum of C76. A quantum chemical study
|
Orlandi, Giorgio |
|
1994 |
224 |
1-2 |
p. 113-117 5 p. |
artikel |
29 |
The CuC bond dissociation energy of CuCH3. A dramatic failure of the QCISD(T) method
|
Böhme, Marlis |
|
1994 |
224 |
1-2 |
p. 195-199 5 p. |
artikel |
30 |
The induced polarization of the water molecule
|
Alkorta, Ibon |
|
1994 |
224 |
1-2 |
p. 160-165 6 p. |
artikel |
31 |
The mutual isomerization of allene and propyne
|
Kiefer, J.H. |
|
1994 |
224 |
1-2 |
p. 51-55 5 p. |
artikel |
32 |
Theoretical analysis of the ligand field spectrum of K3CoF6
|
Vanquickenborne, L.G. |
|
1994 |
224 |
1-2 |
p. 207-212 6 p. |
artikel |
33 |
Theoretical study of siliconsodium binary clusters. Geometrical and electronic structures of Si n Na (n = 1–7)
|
Kishi, Reiko |
|
1994 |
224 |
1-2 |
p. 200-206 7 p. |
artikel |
34 |
Ultrafast optical Kerr effect of phthalocyanine
|
Yuan, Ping |
|
1994 |
224 |
1-2 |
p. 101-105 5 p. |
artikel |
35 |
Ultrasensitive time-resolved linear dichroism spectral measurements using near-crossed linear polarizers
|
Che, Diping |
|
1994 |
224 |
1-2 |
p. 145-154 10 p. |
artikel |
36 |
Variable-effective-field cross polarization. An approach to broadband Hartmann-Hahn matching in MAS NMR
|
Kolbert, Andrew C. |
|
1994 |
224 |
1-2 |
p. 86-90 5 p. |
artikel |