Journal of Physical Chemistry A

Journal of Physical Chemistry A, Vol.112, No.16 Entire volume, number list

ISSN: 1089-5639 (Print)

In this Issue (30 articles)

3499 - 3505	Ionization of imidazole in the gas phase, microhydrated environments, and in aqueous solution. Jagoda-Cwiklik B, Slavicek P, Cwiklik L, Nolting D, Winter B, Jungwirth P
3506 - 3514	Solvation-driven excited-state dynamics of [Re(4-Et-Pyridine)(CO)(3)(2,2'-bipyridine)](+) in imidazolium ionic liquids. A time-resolved infrared and phosphorescence study Blanco-Rodriguez AM, Ronayne KL, Zalis S, Sykora J, Hof M, Vlcek A
3515 - 3522	Evaluation of different implementations of the Thomson liquid drop model: Comparison to monovalent and divalent cluster ion experimental data Donald WA, Williams ER
3523 - 3529	Spatially resolved vibrational energy transfer in molecular monolayers Carter JA, Wang ZH, Dlott DD
3530 - 3543	Ultrafast charge-transfer-to-solvent dynamics of iodide in tetrahydrofuran. 2. Photoinduced electron transfer to counterions in solution Bragg AE, Schwartz BJ
3544 - 3549	Giant chiral asymmetry in the C 1s core level photoemission from randomly oriented fenchone enantiomers Ulrich V, Barth S, Joshi S, Hergenhahn U, Mikajlo E, Harding CJ, Powis I
3550 - 3555	Pd(II) phthalocyanine-sensitized triplet-triplet annihilation from rubrene Singh-Rachford TN, Castellano FN
3556 - 3565	Pd(II) phthalocyanine-sensitized triplet-triplet annihilation from rubrene Singh-Rachford TN, Castellano FN
3566 - 3575	Variational analysis of the phenyl + O-2 and phenoxy plus O reactions da Silva G, Bozzelli JW
3576 - 3586	Electric field effects on one-bond indirect spin-spin coupling constants and possible Biomolecular perspectives Sahakyan AB, Shahkhatuni AG, Shahkhatuni AA, Panosyan HA
3587 - 3596	Absolute thermodynamic measurements of alkali metal cation interactions with a simple dipeptide and tripeptide Ye SJ, Armentrout PB
3597 - 3606	Proton-coupled hole transfer in X-irradiated doped crystalline cytosine center dot H2O Krivokapic A, Herak JN, Sagstuen E
3607 - 3613	Matrix isolation infrared spectroscopic studies and density functional theory calculations of the MNN, (MN)(2) (M = Y and La), and Y3NN molecules Teng YL, Xu Q
3614 - 3626	Role of the ancillary ligand N,N-dimethylaminoethanol in the sensitization of Eu-III and Tb-III luminescence in dimeric beta-diketonates Eliseeva SV, Kotova OV, Gumy F, Semenov SN, Kessler VG, Lepnev LS, Bunzli JCG, Kuzmina NP
3627 - 3630	CO activation on the late lanthanide dimers: Matrix infrared spectra of the Ln(2)[eta(2) (mu(2)-C, O)](x) (Ln = Tb, Dy, Ho, Er, Lu; x=1, 2) molecules Jiang L, Jin X, Zhou MF, Xu Q
3631 - 3637	Reaction mechanism of oxidation, hydroxylation, and epoxidation by hypofluorous acid: A theoretical study of unusual H-bond-assisted catalysis Srnec M, Oncak M, Zahradnik R
3638 - 3645	Differential mobility separation of ions using a rectangular asymmetric waveform Papanastasiou D, Wollnik H, Rico G, Tadjimukhamedov F, Mueller W, Eiceman GA
3646 - 3655	Rotational reorientation dynamics of oxazine 750 in polar solvents Zhou PW, Song P, Liu JY, Shi Y, Han KL, Het GZ
3656 - 3665	Tropospheric oxidation of ethyne and but-2-yne. 1. Theoretical mechanistic study Maranzana A, Ghigo G, Tonachini G, Barkert JR
3666 - 3675	Oxidation of ethyne and but-2-yne. 2. Master equation simulations Maranzana A, Barker JR, Tonachini G
3676 - 3679	On the uptake of ammonia by the water/vapor interface Carignano MA, Jacob MM, Avila EE
3680 - 3692	Quantum chemical and kinetic study of formation of 2-chlorophenoxy radical from 2-chlorophenol: Unimolecular decomposition and bimolecular reactions with H, OH, Cl, and O-2 Altarawneh M, Dlugogorski BZ, Kennedy EM, Mackie JC
3693 - 3699	Shared and closed-shell O-O interactions in silicates Gibbs GV, Downs RT, Cox DF, Ross NL, Boisen MB, Rosso KM
3700 - 3711	Density functional theory calculations of the lowest energy quintet and triplet states of model hemes: Role of functional, basis set, and zero-point energy corrections Khvostichenko D, Choi A, Boulatov R
3712 - 3721	One-electron-transfer reactions of polychlorinated ethylenes: Concerted and stepwise cleavages Bylaska EJ, Dupuis M, Tratnyek PG
3722 - 3730	Microsolvation of glycine: A DFT study Bachrach SM
3731 - 3741	Acetylene cyclotrimerization catalyzed by TiO2 and VO2 in the gas phase: A DFT study Ma YP, Xue W, Wang ZC, Ge MF, He SG
3742 - 3753	Computational and experimental evidence for the structural preference of phenolic C-8 purine adducts Millen AL, McLaughlin CK, Sun KM, Manderville RA, Wetmore SD
3754 - 3767	Stereoelectronic effects on molecular geometries and state-energy splittings of ligated monocopper dioxygen complexes Cramer CJ, Gour JR, Kinal A, Wtoch M, Piecuch P, Shahi ARM, Gagliardi L
3768 - 3786	HN2((2)A') electronic manifold. II. Ab initio based double-sheeted DMBE potential energy surface via a global diabatization angle Mota VC, Varandas AJC