Chemical Physics Letters
Volume 261, Issue 1-2, 11 October 1996
* Spin-orbit effect on the magnetic shielding constant using the ab
initio UHF method: tin tetrahalides
Kaneko, H., Hada, M., Nakajima, T. and Nakatsuji, H.
page 1-6
* Relativistic study of nuclear magnetic shielding constants: tungsten
hexahalides and tetraoxide
Hada, M., Kaneko, H. and Nakatsuji, H.
page 7-12
* Ab initio and density functional theory study of the diazene
isomerization
Jursic, B.S.
page 13-17
* Ab initio MO investigations of molecular structures in the ground and
first excited states of heterocyclic pyridinium betaine
Abe, J., Nemoto, N., Nagase, Y. and Shirai, Y.
page 18-22
* Ab initio calculation of the electrical properties of the X2[Pi.gif]g
ground state of O+2
Feher, M. and Martin, P.A.
page 23-27
* Ab initio polarizabilities of polyenic chains with conformational
defects
de Melo, C.P. and Fonseca, T.L.
page 28-34
* A new ab initio based six-dimensional semi-empirical pair interaction
potential for HF
Klopper, W., Quack, M. and Suhm, M.A.
page 35-44
* Transition state symmetries and theoretical activation enthalpies for
chloride exchange at planar [PdCl4]2_
Deeth, R.J.
page 45-50
* Variational calculations of the rovibrational energy levels of K2Na+
Smart, B., Marsden, C., Hughes, J.M., Feng, W. and von Nagy-Felsobuki,
E.I.
page 51-56
* Vibrational polarizability and hyperpolarizability of p-nitroaniline
Champagne, B.
page 57-65
* Theoretical studies of the electronic structures and linear, nonlinear
optics of K3-xLi2+xNb5O15 with x = 0 and x = 1
Wen-Dan, C., Jiu-Tong, C., Jin-Shun, H. and Qian-Er, Z.
page 66-74
* A cluster model study for Li KVV transitions on a Cu (001) surface
Noro, T., Yamagishi, H. and Miyoshi, E.
page 75-80
* Computer simulation of the surface roughness of lipid membranes
Schneider, K.
page 81-85
* An exact hard-spheres scattering model for the mobilities of
polyatomic ions
Shvartsburg, A.A. and Jarrold, M.F.
page 86-91
* Isolation and characterization of a new metallofullerene Nd_C82
Junqi, D., Nian, L., Lu-Tao, W., Cue, N. and Shihe, Y.
page 92-97
* Theoretical study of the ethylene electronic spectrum and extraction
of an r-dependent Hubbard Hamiltonian
Garcia, V.M., Caballol, R. and Malrieu, J.P.
page 98-104
* A family of attenuated Coulomb operators
Gill, P.M.W. and Adamson, R.D.
page 105-110
* A theory for the quantum activated rate constant in dissipative
systems
Jianshu, C. and Voth, G.A.
page 111-116
* Ultrafast transient absorption spectroscopy of the hydrated electron:
a theory
Bratos, S. and Leicknam, J.-Cl.
page 117-122
* Kinetic exchange and strong ferromagnetic interactions
Weihe, H. and Gudel, H.U.
page 123-128
* Theoretical study of the effective exchange interactions between
nitroxides via hydrogen atoms
Kawakami, T., Takeda, S., Mori, W. and Yamaguchi, K.
page 129-137
* Atmospheric chemistry of bifunctional cycloalkyl nitrates
Wangberg, I., Barnes, I. and Becker, K.H.
page 138-144
* Toward understanding the role of Stark effects when probing the
nuclear hyperfine states of atomic hydrogen
Lorenz, K.T., Cowen, K.A., Fleming, P.E., Mathews, M.G., Herman, M.F.
and Koplitz, B.
page 145-154
* The heat of formation of ClSO+
Mayer, P.M. and Baer, T.
page 155-159
* CIDEP study on the flash photolysis of benzoin included in
[beta.gif]-cyclodextrin
Kitahama, Y. and Murai, H.
page 160-164
* Femtosecond vibrational dynamics and relaxation in the core
light-harvesting complex of photosynthetic purple bacteria
Chachisvilis, M. and Sundstrom, V.
page 165-174
* Observation of the O_u(3P1) ion-pair state of Cl2 by
perturbation-facilitated optical-optical double resonance
Ishiwata, T., Kasai, Y. and Obi, K.
page 175-180
* Reorientation of transition dipoles during exciton relaxation in
J-aggregates probed by fluorescence anisotropy
Scheblykin, I.G., Drobizhev, M.A., Varnavsky, O.P., Van der Auweraer,
M. and Vitukhnovsky, A.G.
page 181-190
* Time-resolved spectroscopic study of the initial process of
photopolymerization in a diacetylene crystal
Itoh, C., Kondoh, T. and Tanimura, K.
page 191-194
* Velocity selected laser polarization spectroscopy: a powerful and
versatile method of obtaining the state-to-state differential cross
section
Wilson, R.J. and McCaffery, A.J.
page 195-200
* Rotational coherence spectroscopy of 9,9_-bianthryl and its van der
Waals complexes with Ar and H2O
Fujiwara, T., Fujimura, Y. and Kajimoto, O.
page 201-207
* Temperature dependent kinetics of the picosecond bimolecular reaction
between S1 trans-stilbene and carbon tetrachloride: is the ultrafast
photochemical reaction diffusion-controlled?
Iwata, K. and Hamaguchi, H.
page 208-212
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