Journal of Physical Chemistry, 1998, V 102, N 48, Nov 26.
Effect of silyl substitution on the frontier orbitals of diimines.
[Letter]
Modelli A; Scagnolari F; Jones D; Distefano G.
pp 9675-9678
Intramolecular energy transfer in fullerene pyrazine dyads.
Guldi DM; Torres-Garcia G; Mattay J.
pp 9679-9685
Vibrational relaxation dynamics of trans-stilbene in the lowest excited
singlet state. Pump and probe wavelength dependencies of the picosecond
time-resolved anti-Stokes Raman spectrum.
Nakabayashi T; Okamoto H; Tasumi M.
pp 9686-9695
Controlling the orientation of hexapole-selected hydroxyl (OH) radicals.
Hain TD; Curtiss TJ.
pp 9696-9701
Periodicity and chaos in chemiluminescence: The ruthenium-catalyzed
Belousov-Zhabotinsky reaction.
Zeyer KP; Schneider FW.
pp 9702-9709
Excited-state proton transfer of 1-naphthol in micelles.
Mandal D; Pal SK; Bhattacharyya K.
pp 9710-9714
Infrared chemiluminescence study of the reactions of hydroxyl radicals
with formaldehyde and formyl radicals with H, OH, NO, and NO2.
Butkovskaya NI; Setser DW.
pp 9715-9728
Relaxation dynamics of inhomogeneous spectral width in binary solvents
studied by transient hole-burning spectroscopy.
Nishiyama K; Okada T.
pp 9729-9733
Femtosecond time-resolved CARS spectroscopy on binary gas-phase mixtures:
A theoretical and experimental study of the benzene/toluene system.
Rubner O; Schmitt M; Knopp G; Materny A; Kiefer W; Engel V.
pp 9734-9738
Theoretical study on photophysical and photochemical properties of a
merocyanine dye.
Hammam E; El-Nahas AM.
pp 9739-9744
Line width distributions in single-molecule spectroscopy due to optical
saturation.
Kador L.
pp 9745-9749
Characterization of anisotropic aluminum magnetic shielding tensors.
Distorted octahedral complexes and linear molecules. [Review]
Schurko RW; Wasylishen RE; Foerster H.
pp 9750-9760
State-resolved studies of collisional quenching of highly vibrationally
excited pyrazine by water: The case of the missing V -> RT supercollision
channel.
Fraelich M; Elioff MS; Mullin AS.
pp 9761-9771
Infrared spectrum of the nitrosyl chloride monomer and dimer in solid
nitrogen: Temperature-induced mobility of nitrosyl chloride.
Schriver-Mazzuoli L; Hallou A; Schriver A.
pp 9772-9778
Infrared spectroscopy of intramolecular hydrogen-bonded OH stretching
vibrations in jet-cooled methyl salicylate and its clusters.
Mitsuzuka A; Fujii A; Ebata T; Mikami N.
pp 9779-9784
Electronic absorption spectra of the polyacetylene chains HC2nH, HC2nH-,
and HC2n-1N- (n = 6-12) in neon matrixes.
Grutter M; Wyss M; Fulara J; Maier JP.
pp 9785-9790
Structures of gas-phase (C-60)(n)(CN)(m) trianions from reactions of C-60
with NaCN in solution.
Tuinman AA; Compton RN.
pp 9791-9796
Spectroscopic studies of fullerene aggregates.
Rudalevige T; Francis AH; Zand R.
pp 9797-9802
Sequential ligation of Mg+, Fe+, (c-C5H5)Mg+, and (c-C5H5)Fe+ with ammonia
in the gas phase: Transition from coordination to solvation in the
sequential ligation of Mg+.
Milburn RK; Baranov VI; Hopkinson AC; Bohme DK.
pp 9803-9810
Transition-state theory based modeling of the dynamics of the O+(S-4)+CO2
reaction.
Sawilowsky EF; Klippenstein SJ.
pp 9811-9818
Trajectory studies of S(N)2 nucleophilic substitution. 7. F-+CH3Cl ->
FCH3+Cl-.
Su T; Wang HB; Hase WL.
pp 9819-9828
Solvent effects on the O-2(a(1)Delta(g))-O-2(X-3 Sigma(-)(g)) radiative
transition: Comments regarding charge-transfer interactions.
Poulsen TD; Ogilby PR; Mikkelsen KV.
pp 9829-9832
Effect of charge-transfer interactions on the radiative rate constant of
(1)Delta(g) singlet oxygen.
Darmanyan AP.
pp 9833-9837
Antioxidant chemistry: Hypotaurine-taurine oxidation by chlorite.
Martincigh BS; Mundoma C; Simoji RH.
pp 9838-9846
Testing frontier orbital control: Kinetics of OH with ethane, propane, and
cyclopropane from 180 to 360K.
Clarke JS; Kroll JH; Donahue NM; Anderson JG.
pp 9847-9857
Equilibrium geometry and properties of cyclo[(Gly-D-Ala)4] and
{cyclo[(Gly-D-Ala)4]}2 from density functional theory.
Jishi RA; Flores RM; Valderrama M; Lou L; Bragin J.
pp 9858-9862
A theoretical study of the mechanism of the hydride transfer reaction
between alkanes and alkenes catalyzed by an acidic zeolite.
Boronat M; Viruela P; Corma A.
pp 9863-9868
Ab initio study of the mechanism for the reaction of CF2 radicals with OH.
Liu RF; Francisco JS.
pp 9869-9875
Ab initio based configuration interaction calculations on the low-lying
electronic states of GaAs.
Manna B; Das KK.
pp 9876-9883
DFT and ab initio study of the unimolecular decomposition of the lowest
singlet and triplet states of nitromethane.
Manaa MR; Fried LE.
pp 9884-9889
Computationally inexpensive theoretical thermochemistry.
Cioslowski J; Liu GH; Piskorz P.
pp 9890-9900
Conformational properties of 1,3-difluoropropane.
Wu D; Tian A; Sun H.
pp 9901-9905
Aza-substituted thiophene derivatives: Structures, dipole moments, and
polarizabilities.
Kassimi NEB; Lin ZJ.
pp 9906-9911
Derivatives of molecular valence as a measure of aromaticity.
Balawender R; Komorowski L; De Proft F; Geerlings P.
pp 9912-9917
Theoretical study of the reaction (1)[: CH2]+CHO+-> CH3++CO.
Diaz N; Suarez D; Sordo TL.
pp 9918-9924
Bifurcated hydrogen bonds: Three-centered interactions.
Rozas I; Alkorta I; Elguero J.
pp 9925-9932
An ab initio and Raman investigation of magnesium(II) hydration.
Pye CC; Rudolph WW.
pp 9933-9943
A density functional treatment of chemical reactivity and the associated
electronic structure principles in the excited electronic states.
Chattaraj PK; Poddar A.
pp 9944-9948
Gas-phase syntheses of three isomeric C5H2 radical anions and their
elusive neutrals. A joint experimental and theoretical study.
Blanksby SJ; Dua S; Bowie JH; Schroder D; Schwarz H.
pp 9949-9956
Conservation of bond order during radical substitution reactions:
Implications for the BEBO model.
Blowers P; Masel RI.
pp 9957-9964
Theoretical thermochemistry of homolytic C-C and C-Cl bond dissociations
in unbranched perchloroalkanes.
Cioslowski J; Liu GH; Moncrieff D.
pp 9965-9969
Density-functional study of the equilibrium structures, vibrational
spectra, and energetics of CH3OBr and CH3BrO.
Guha S; Francisco JS.
pp 9970-9974
A four-member ring hypervalent iodine radical.
Miranda MA; Perez-Prieto J; Font-Sanchis E; Konya K; Scaiano JC.
pp 9975-9977
Hydration energies and entropies for Mg2+, Ca2+, Sr2+, and Ba2+ from
gas-phase ion-water molecule equilibria determinations.
Peschke M; Blades AT; Kebarle P.
pp 9978-9985