Journal of Physical Chemistry A

Journal of Physical Chemistry A, Vol.102, No.20 Entire volume, number list

ISSN: 1089-5639 (Print)

In this Issue (23 articles)

3459 - 3461	A (2)Sigma(+)<- X-2 Pi electronic absorption spectrum of CCO- in a neon matrix Fulara J, Grutter M, Wyss M, Maier JP
3462 - 3469	Electronic spectroscopy of carbon chains Maier JP
3470 - 3480	Laser flash photolysis studies on the monohydroxy derivatives of benzophenone Bhasikuttan AC, Singh AK, Palit DK, Sapre AV, Mittal JP
3481 - 3491	Photochemical reaction dynamics of O(D-1) with saturated hydrocarbons, CH4, C2H6, and C3H8, under bulk conditions and in van der Waals complexes Wada S, Obi K
3492 - 3497	Consecutive biradicals during the photolysis of 2,12-dihydroxy-2,12-dimethylcyclododecanone : Low- and high-field chemically induced dynamic nuclear polarizations (CIDNP) study Morozova OB, Tsentalovich YP, Yurkovskaya AV, Sagdeev RZ
3498 - 3504	Photodissociation of gas-phase polycylic aromatic hydrocarbon cations Ekern SP, Marshall AG, Szczepanski J, Vala M
3505 - 3513	Analysis of a solid-state conformational rearrangement using N-15 NMR and X-ray crystallography McGeorge G, Harris RK, Batsanov AS, Churakov AV, Chippendale AM, Bullock JF, Gan ZH
3514 - 3523	Excited-state reaction dynamics of chlorine dioxide in water from absolute resonance Raman intensities Foster CE, Reid PJ
3524 - 3531	Electron energy loss and DFT/SCI study of the singlet and triplet excited states and electron attachment energies of tetramethylsilane, hexamethyldisilane, tris(trimethylsilyl)silane, and tetramethoxysilane Huber V, Asmis KR, Sergenton AC, Allan M, Grimme S
3532 - 3536	Substituent effects in mixed trihalobenzenes Novak I, Potts AW
3537 - 3555	Thermochemical and kinetic analysis of the H, OH, HO2, O, and O-2 association reactions with cyclopentadienyl radical Zhong X, Bozzelli JW
3556 - 3559	Investigation on the insertion channel in the S(P-3)+H-2 reaction Shiina H, Miyoshi A, Matsui H
3560 - 3564	Stabilized Koopmans' theorem calculations on the pi* anion states of 1,4,5,8-tetrahydronaphthalene Wei YH, Cheng HY
3565 - 3573	Hydrolysis of ferric ion in water and conformational equilibrium Martin RL, Hay PJ, Pratt LR
3574 - 3581	Hydrogen-bonding cooperativity and competing inter- and intramolecular associations : A unified approach Missopolinou D, Panayiotou C
3582 - 3586	Ab initio study of intramolecular proton transfer in formohydroxamic acid Wu DH, Ho JJ
3587 - 3591	Theoretical study of the photodecomposition of methyl Hg complexes Tossell JA
3592 - 3598	Influence of ancillary ligands on the kinetics and the thermodynamics of H-2 addition to IrXH2(PR3)(2) (X = Cl, Br, I and R = H, Me) : Comparison between density functional theory and perturbation theory Clot E, Eisenstein O
3599 - 3606	Coordination geometry of the copper-pyridine complex in frozen solution as studied by proton and deuterium two-dimensional hyperfine sublevel correlation electron spin resonance spectroscopy Poppl A, Hartmann M, Bohlmann W, Bottcher R
3607 - 3613	Reactivity indices in density functional theory : A new evaluation of the condensed Fukui function by numerical integration Gilardoni F, Weber J, Chermette H, Ward TR
3614 - 3617	Insight into chemical reactions from first-principles simulations : The mechanism of the gas-phase reaction of OH radicals with ketones Frank I, Parrinello M, Klamt A
3618 - 3624	Variety of [Fe, N, O] isomers. A theoretical study Fiedler A, Iwata S
3625 - 3634	Gas-phase basicity of glycine : A comprehensive ab initio study Zhang K, Chung-Phillips A