Journal of Chemical Physics
22 Jun 1997, V106, N24.
%T Hyperfine decoupling in electron spin resonance
%A Gunnar Jeschke and Arthur Schweiger
%T Erratum: Group VI trimers (Se{_3}, Te{_3}, and Po{_3}).
Electronic states and potential energy surfaces
[J.Chem.Phys. 99, 5239 (1993)]
%A Dingguo Dai and K.Balasubramanian
%T Photodissociation spectroscopy and dynamics of the HCCO free radical
%A David L.Osborn, David H.Mordaunt, Hyeon Choi, Ryan T.Bise,
Daniel M.Neumark, and Celeste McMichael Rohlfing
%T Spectroscopic studies of the B{^~ 2}A"-X {^2}A" system
of the jet-cooled vinoxy radical
%A L.R.Brock and Eric A.Rohlfing
%T Energy transfer and surface-induced dissociation for
SiMe{_3}{^+} scattering off clean and adsorbate covered metals
%A Samuel B.Wainhaus, Hanjo Lim, David G.Schultz, and Luke Hanley
%T Classical dynamics simulations of SiMe{_3}{^+}
ion-surface scattering
%A David G.Schultz, Samuel B.Wainhaus, Luke Hanley,
Pascal de Sainte Claire, and William L.Hase
%T The effect of two- and three-body interactions in Ar{_n}CO{_2}
(n=1,2) on the asymmetric stretching CO{_2} coordinate.
An ab initio study
%A Janusz Rak, M.M.Scczesniak, Grzegorz Chalasinski,
and Slawomir M.Cybulski
%T Improving harmonic vibrational frequencies calculations
in density functional theory
%A R.Eric Stratmann, John C.Burant, Gustavo E.Scuseria,
and Michael J.Frisch
%T Resonance-enhanced multiphoton electron detachment (REMPED)
spectra of C{_7}{^-}, C{_9}{^-} and C{_11}{^-}
%A M.Ohara, H.Shiromaru, and Y.Achiba
%T Finding transition states using contangency curves
%A Alex Ulitsky and David Shalloway
%T Numerical application of the coupled cluster theory with localized
orbitals to polymers. IV. Band structure corrections in model
systems and polyacetylene
%A Wolfgang Forner, Reinhard Knab, Jiri Cizek and Janos Ladik
%T Ultraviolet laser desorption of indole
%A Jeffrey W.Elam and Donald H.Levy
%T Translational energy distributions of the products
of the 193 and 157 nm photodissociations of chloroethenes
%A Kei Sato, Shigeru Tsunashima, Toshiyuki Takayanagi,
Ginji Fujisawa, and Atsushi Yokoyama
%T Binding energies of Ti{^+}(H{_2}){_1-6} clusters. Theory
and experiment
%A John E.Bushnell, Philippe Maitre, Paul R.Kemper, Michael T.Bowers
%T Eigensolution of a singular operator
{delta}({chi})d/dx + d/dx{delta}({chi})
%A Tae Jun Park
%T The photodissociation of SiO
%A G.Jolicard, J.-M.Zucconi, I.Drira, A.Spielfieldel, and N.Feautrier
%T Rate coefficients for the endothermic reactions
C{^+}({^2}P) + H{_2}(D{_2}) --> CH{^+}(CD{^+}) + H(D) as
functions of temperature from 400 - 1300 K
%A Peter M.Hierl, Robert A.Morris, and A.A.Viggiano
%T Rare gas scattering from molten metals examined
with classical scattering theory
%A Andre Muis and J.R.Manson
%T Ab initio quantum chemical calculation of electron
transfer matrix elements for large molecules
%A Linda Yu Zhang, Richard A.Friesner, and Robert B.Murphy
%T Electron-electron-nuclear three-spin mixing in
spin-correlated radical pairs
%A Gunnar Jeschke
%T The equilibrium structure of silene H{_2}C=SiH{_2} from
millimeter wave spectra and from ab initio calculations
%A Stephane Bailleux, Marcel Bogey, Jean Demaison,
Hans Burger, Michael Senzlober, Jurgen Breidung,
Walter Thiel, Radek Fajgar, and Josef Pola
%T The diffusion of oxygen on W(110) revisited
%A T.-U.Nahm and R.Gomer
%T Vibrational anharmonicity and multilevel vibrational dephasing
from vibrational echo beats
%A K.D.Rector, A.S.Kwok, C.Ferrante, A.Tokmakoff, C.W.Rella,
and M.D.Fayer
%T Structure, vertical electron-detachment energy,
and O-H stretching frequencies of e+(H{_2}O){_12}
%A Johngseob Kim, Jung Mee Park, Kyung Seok Oh, Jin Yong Lee,
Sik Lee, and Kwang S.Kim
%T Distributions and averages of electron density parameters.
Explaining the effects of gradient corrections
%A Ales Zupan, Kieron Burke, Matthias Ernzerhof, and John P.Perdew
%T First-order intermolecular DIM potentials. I. Potential energy
surfaces, spectra, and fragmentation dynamics of the Ne...Cl{_2}
complex
%A A.A.Buchachenko and N.F.Stepanov
%T Charge penetration in dielectric models of solvation
%A Daniel M.Chipman
%T Predicting the viscosity of alkanes using non-equilibrium
molecular dynamics. Evaluation of intermolecular potential models
%A William Allen and Richard L.Rowley
%T Circumventing the pathological behavior of path-
integral Monte Carlo for systems with Coulomb potentials
%A M.H.Muser and B.J.Berne
%T Improved treatment of inertia and non-Markovian effects on
short-time dynamics of diffusion-controlled reaction based on
generalized diffusion equation
%A Kazuyasu Ibuki and Masakatsu Ueno
%T The isotropic-nematic transition for the hard Gaussian
overlap fluid. Testing the decoupling approximation
%A P.Padilla and E.Velasco
%T First passage times, correlation functions, and reaction rates
%A D.J.Bicout and Attila Szabo
%T Non-random behavior in multicomponent mixtures.
Effects of solute size and shape
%A G.L.Aranovich, T.Hocker, D.W.Wu, and M.D.Donohue
%T Thermodynamics of the Tl-O system and Tl-superconductors
%A P.G.Wahlbeck and Dwight L.Myers
%T Exact derivation of extended thermodynamics from
the Robertson statistical formalism
%A R.E.Nettleton
%T A 250 GHz ESR study of o-terphenyl. Dynamic
cage effects above T{_c}
%A Keith A.Earle, Jozef K.Moscicki, Antonino Polimeno, and Jack H.Freed