Journal of Physical Chemistry A

Journal of Physical Chemistry A, Vol.115, No.26 Entire volume, number list

ISSN: 1089-5639 (Print)

In this Issue (56 articles)

7401 - 7405	Photophysical Properties of 9,10-Disubstituted Anthracene Derivatives in Solution and Films Ribierre JC, Ruseckas A, Cavaye H, Barcena HS, Burn PL, Samuelt IDW
7406 - 7412	Photoexcited Chemical Wave in the Ruthenium-Catalyzed Belousov-Zhabotinsky Reaction Nakata S, Matsushita M, Sato T, Suematsu NJ, Kitahata H, Amemiya T, Mori Y
7413 - 7417	Quasi-Classical Trajectory-Gaussian Binning Study of the OH + D-2 -> HOD(v(1)',v(2)',v(3)') + D Angle-Velocity and Vibrational Distributions at a Collision Energy of 0.28 eV Sierra JD, Bonnet L, Gonzalez M
7418 - 7427	Role of the Low-Energy Excited States in the Radiolysis of Aromatic Liquids Baidak A, Badali M, LaVerne JA
7428 - 7436	Mobility of Solid tert-Butyl Alcohol Studied by Deuterium NMR Nishchenko AM, Kolokolov DI, Stepanov AG
7437 - 7447	Quantum Cascade Laser Spectroscopy and Photoinduced Chemistry of Al-(CO)(n) Clusters in Helium Nanodroplets Liang T, Flynn SD, Morrison AM, Douberly GE
7448 - 7455	Helical Superstructure and Charged Polarons Contributions to Optical Non linearity of 2-Methyl-4-nitroaniline Crystals Studied by Resonance Raman, Electron Paramagnetic Resonance, Circular Dichroism Spectroscopies, and Quantum Chemical Calculations Szostak MM, Chojnacki H, Piela K, Okwieka-Lupa U, Bidzinska E, Dyrek K
7456 - 7460	Symmetry-Switching Molecular Fe(O-2)(n)(+) Clusters Mpourmpakis G, Velegrakis M, Mihesan C, Andriotis AN
7461 - 7472	Competition between Hydrogen Bonding and Dispersion Interactions in the Indole center dot center dot center dot Pyridine Dimer and (Indole)(2) center dot center dot center dot Pyridine Trimer Studied in a Supersonic Jet Kumar S, Biswas P, Kaul I, Das A
7473 - 7483	Conformational Stability from Variable-Temperature Infrared Spectra of Xenon Solutions, r(0) Structural Parameters, and Vibrational Assignment of Pyrrolidine Durig JR, El-Defrawy AM, Ganguly A, Panikar SS, Soliman MS
7484 - 7493	Hybrid Organo-Inorganic Clay with Nonionic Inter layers. Mid- and Near-IR Spectroscopic Studies Finocchio E, Baccini I, Cristiani C, Dotelli G, Stampino PG, Zampori L
7494 - 7502	UV Photolysis of alpha-Cyclohexanedione in the Gas Phase Mukhopadhyay A, Mukherjee M, Ghosh AK, Chakraborty T
7503 - 7510	Raman and Inelastic Neutron Scattering Study on a Melt-Infiltrated Composite of NaAlH4 and Nanoporous Carbon Colognesi D, Giannasi A, Ulivi L, Zoppi M, Ramirez-Cuesta AJ, Roth A, Fichtner M
7511 - 7520	H/D Isotopic Recognition in Hydrogen-Bonded Systems: Strong Dynamical Coupling Effects in the Polarized IR Spectra of 3-Methylthioacetanilide and 4-Methylthioacetanilide Crystals Flakus HT, Smiszek-Lindert W, Hachula B
7521 - 7530	Time-Resolved Resonance Raman and Computational Investigation of the Influence of 4-Acetamido and 4-N-Methylacetamido Substituents on the Chemistry of Phenylnitrene Xue JD, Vyas S, Du Y, Luk HL, Chuang YP, But TYS, Toy PH, Wang J, Winter AH, Phillips DL, Hadad CM, Platz MS
7531 - 7537	Solvent Effects on Chemical Exchange in a Push-Pull Ethylene as Studied by NMR and Electronic Structure Calculations Ababneh-Khasawneh M, Fortier-McGill BE, Occhionorelli ME, Bain AD
7538 - 7549	Ultrafast Intersystem Crossing and Spin Dynamics of Zinc meso-Tetraphenylporphyrin Covalently Bound to Stable Radicals Colvin MT, Smeigh AL, Giacobbe EM, Conron SMM, Ricks AB, Wasielewski MR
7550 - 7558	Ultrafast Branching of Reaction Pathways in 2-(2'-Hydroxyphenyl)benzothiazole in Polar Acetonitrile Solution Mohammed OF, Luber S, Batista VS, Nibbering ETJ
7559 - 7565	Microwave Spectrum and Conformational Composition of 1-Vinylimidazole Samdal S, Mollendal H
7566 - 7573	Time-Resolved Resonance Raman Spectroscopic Studies on the Triplet Excited State of Thioxanthone Pandey R, Umapathy S
7574 - 7581	Electronic Energy Migration in Solid versus Liquid Host Matrices for Concentrated Perylenediimide Dye Solutions Colby KA, Bardeen CJ
7582 - 7590	The Importance of NO+(H2O)(4) in the Conversion of NO+(H2O)(n) to H3O+(H2O)(n): I. Kinetics Measurements and Statistical Rate Modeling Eyet N, Shuman NS, Viggiano AA, Troe J, Relph RA, Steele RP, Johnson MA
7591 - 7601	Excited-State Intermolecular Proton Transfer of Firefly Luciferin V. Direct Proton Transfer to Fluoride and Other Mild Bases Presiado I, Gepshtein R, Erez Y, Huppert D
7602 - 7609	Infrared Spectroscopy of Mn+(H2O) and Mn2+(H2O) via Argon Complex Predissociation Carnegie PD, Bandyopadhyay B, Duncan MA
7610 - 7624	Kinetics and Mechanisms of the Allyl plus Allyl and Allyl plus Propargyl Recombination Reactions Matsugi A, Suma K, Miyoshi A
7625 - 7632	Infrared Multiphoton Dissociation Spectroscopy Study of Protonated p-Aminobenzoic Acid: Does Electrospray Ionization Afford the Amino- or Carboxy-Protonated Ion? Schmidt J, Meyer MM, Spector I, Kass SR
7633 - 7637	Viability of Clathrate Hydrates as CO2 Capturing Agents: A Theoretical Study Srivastava HK, Sastry GN
7638 - 7644	Reaction Kinetics of CO2 Carbonation with Mg-Rich Minerals Kwon S, Fan MH, Dacosta HFM, Russell AG, Tsouris C
7645 - 7655	Divalent N(I) Compounds with Two Lone Pairs on Nitrogen Patel DS, Bharatam PV
7656 - 7663	Doping Effects on Structural and Electronic Properties of Ladderanes and Ladder Polysilanes: A Density Functional Theory Investigation Wang X, Lau KC, Li WK
7664 - 7672	Computational Study of Cycloaddition Reactions of 16-Electron d(8) ML4 Complexes with C-60 Sheu JH, Su MD
7673 - 7686	Electronic Structure and Thermochemical Properties of Small Neutral and Cationic Lithium Clusters and Boron-Doped Lithium Clusters: Li-n(0/+) and LinB0/+ (n=1-8) Tai TB, Nhat PV, Nguyen MT, Li SG, Dixon DA
7687 - 7699	Ab Initio Studies of Aromatic Excimers Using Multiconfiguration Quasi-Degenerate Perturbation Theory Shirai S, Iwata S, Tani T, Inagaki S
7700 - 7708	Dimer Radical Cations of Indole and Indole-3-carbinol: Localized and Delocalized Radical Cations of Diindolylmethane Bloch-Mechkour A, Bally T, Marcinek A
7709 - 7721	Carbonyl Oxides Reactions from Geraniol-trans-(3,7-dimethylocta-2,6-dien-1-ol), 6-Methyl-5-hepten-2-one, and 6-Hydroxy-4-methyl-4-hexenal Ozonolysis: Kinetics and Mechanisms Leonardo T, Baptista L, da Siva EC, Arbilla G
7722 - 7733	Comprehensive Core-Level Study of the Effects of Isomerism, Halogenation, and Methylation on the Tautomeric Equilibrium of Cytosine Feyer V, Plekan O, Kivimaki A, Prince KC, Moskovskaya TE, Zaytseva IL, Soshnikov DY, Trofimov AB
7734 - 7743	Role of Hydrogen in Dimerizaton of Aluminum Clusters: A Theoretical Study Varano A, Henry DJ, Yarovsky I
7744 - 7752	Theoretical Study of the Equilibrium Structure, Vibrational Spectrum, and Thermochemistry of the Peroxynitrate CF2BrCFBrOONO2 Badenes MP, Bracco LLB, Cobos CJ
7753 - 7764	Carbon Dioxide in the Nitrosation of Amine: Catalyst or Inhibitor? Sun Z, Liu YD, Zhong RG
7765 - 7772	Benchmark Theoretical Study on the Dissociation Energy of Chlorine Csontos J, Kallay M
7773 - 7777	Computational Investigation of the Role of Counterions and Reorganization Energy in a Switchable Bistable [2]Rotaxane Foster ME, Sohlberg K
7778 - 7784	Exploring the Sources of the Magnetic Anisotropy in a Family of Cyanide-Bridged Ni9Mo6 and Ni9W6 Systems: A Density Functional Theory Study Zhang YQ, Luo CL
7785 - 7793	Thermodynamics of Boroxine Formation from the Aliphatic Boronic Acid Monomers R-B(OH)(2) (R = H, H3C, H2N, HO, and F): A Computational Investigation Bhat KL, Markham GD, Larkin JD, Bock CW
7794 - 7804	Understanding Thermodynamic Properties at the Molecular Level: Multiple Temperature Charge Density Study of Ribitol and Xylitol Madsen AO, Mattson R, Larsen S
7805 - 7810	Theoretical Study of the 1:1 and 2:1 (Homo- and Heterochiral) Complexes of XOOX' (X, X' = H, CH3) with Lithium Cation Alkorta I, Elguero J, Provasi PF, Ferraro MB
7811 - 7814	Spontaneous Dissociation of Xenon Tetroxide: Phase and Structural Changes Slepkov V, Kozlova S, Gabuda S
7815 - 7822	Role of the (3)(pi pi*) State in Photolysis of Lumisantonin: Insight from ab Initio Studies Chen X, Rinkevicius Z, Luo Y, Agren H, Cao ZX
7823 - 7833	High-Accuracy Theoretical Thermochemistry of Atmospherically Important Sulfur-Containing Molecules Nagy B, Szakacs P, Csontos J, Rolik Z, Tasi G, Kallay M
7834 - 7848	Photoinduced Rearrangement of Aromatic N-Chloroamides to Chloroaromatic Amides in the Solid State: Inverted Pi(N)-Sigma(N) Occupational Stability of Amidyl Radicals Naumov P, Topcu Y, Eckert-Maksic M, Glasovac Z, Pavosevic F, Kochunnoonny M, Hara H
7849 - 7857	Unexpected Nonadditivity Effects in Anion-pi Complexes Estarellas C, Frontera A, Quinonero D, Deya PM
7858 - 7860	Comment on "Exothermic Rate Restrictions in Long-Range Photoinduced Charge Separations" Angulo G, Rosspeintner A, Vauthey E
7861 - 7862	Reply to "Comment on'Exothermic Rate Restrictions in Long-Range Photoinduced Charge Separations in Rigid Media'" Serpa C, Nunes RMD, Arnaut LG, Formosinho SJ
7863 - 7864	Comment on "Revised Mechanism of Boyland-Sims Oxidation" Behrman EJ
7865 - 7868	Reply to "Comment on'Revised Mechanism of Boyland-Sims Oxidation'" Marjanovic B, Juranic I, Ciric-Marjanovic G
7869 - 7870	Comment on "Electronic Structures, Vibrational and Thermochemical Properties of Neutral and Charged Niobium Clusters Nb-n, n=7-12" Fielicke A, Meijer G
7871 - 7871	Binding of CO, NO, and O-2 to Heme by Density Functional and Multireference ab Initio Calculations (vol 112, pg 11824, 2008) Radon M, Pierloot K