Journal of Physical Chemistry A

Journal of Physical Chemistry A, Vol.119, No.24 Entire volume, number list

ISSN: 1089-5639 (Print)

In this Issue (44 articles)

6155 - 6161	Picosecond Dynamics of Avobenzone in Solution Dunkelberger AD, Kieda RD, Marsh BM, Crim FF
6162 - 6170	Reactivity and Catalytic Activity of Hydrogen Atom Chemisorbed Silver Clusters Manzoor D, Pal S
6171 - 6178	Size Resolved High Temperature Oxidation Kinetics of Nano-Sized Titanium and Zirconium Particles Zong YC, Jacob RJ, Li SQ, Zachariah MR
6179 - 6187	Rate Coefficients for the Gas-Phase Reactions of Hydroxyl Radicals with a Series of Methoxylated Aromatic Compounds Lauraguais A, Bejan I, Barnes I, Wiesen P, Coeur C
6188 - 6194	Vibrational and Rotational Mode Specificity in The Cl + H2O -> HCl plus OH Reaction: A Quantum Dynamical Study Song HW, Guo H
6195 - 6202	Highly Selective Dissociation of a Peptide Bond Following Excitation of Core Electrons Lin YS, Tsai CC, Lin HR, Hsieh TL, Chen JL, Hu WP, Ni CK, Liu CL
6203 - 6214	Time-Resolved Transient Optical Absorption Study of Bis(terpyridyl)oligothiophenes and Their Metallo-Supramolecular Polymers with Zn(II) Ion Couplers Rais D, Mensik M, Stenclova-Blahova P, Svoboda J, Vohlidal J, Pfleger J
6215 - 6222	Photochemical Degradation of the Anticancer Drug Bortezomib by V-UV/UV (185/254 nm) Investigated by H-1 NMR Fingerprinting: A Way to Follow Aromaticity Evolution Martignac M, Balayssac S, Gilard V, Benoit-Marquie F
6223 - 6231	Cation-Anion Dual Sensing of a Fluorescent Quinoxalinone Derivative Using Lactam-Lactim Tautomerism Nakane Y, Takeda T, Hoshino N, Sakai K, Akutagawa T
6232 - 6243	Intramolecular Charge-Transfer Excited-State Processes in 4-(N,N-Dimethylamino)benzonitrile: The Role of Twisting and the pi sigma* State Georgieva I, Aquino AJA, Plasser F, Trendafilova N, Kohn A, Lischka H
6244 - 6251	Examining the Critical Roles of Protons in Facilitating Oxidation of Chloride Ions by Permanganates: A Cluster Model Study Zhang J, Sun ZR, Wang XB
6252 - 6256	Photoreduction of Sm3+ in Nanocrystalline BaFCl Riesen N, Francois A, Badek K, Monro TM, Riesen H
6257 - 6268	Dispersed Fluorescence Spectroscopy of Jet-Cooled 2-, 3-, and 4-Methylcyclohexoxy Radicals Alam J, Reza MA, Mason A, Reilly NJ, Liu JJ
6269 - 6274	Intersystem Crossing Pathway in Quinoline-Pyrazole Isomerism: A Time-Dependent Density Functional Theory Study on Excited-State Intramolecular Proton Transfer Liu YH, Lan SC, Zhu CY, Lin SH
6275 - 6282	Excited-State Vibrational Coherence in Perylene Bisimide Probed by Femtosecond Broadband Pump-Probe Spectroscopy Son M, Park KH, Yoon MC, Kim P, Kim D
6283 - 6295	Tuning the Direction of Intramolecular Charge Transfer and the Nature of the Fluorescent State in a T-Shaped Molecular Dyad Felouat A, D'Aleo A, Charaf-Eddin A, Jacquemin D, Le Guennic B, Kim E, Lee KJ, Woo JH, Ribierre JC, Wu JW, Fages F
6296 - 6308	Infrared Spectrum and UV-Induced Photochemistry of Matrix-Isolated 5-Hydroxyquinoline Kus N, Sagdinc S, Fausto R
6309 - 6316	Trends in Atomic Parameters for Crystals and Free Ions across the Lanthanide Series: The Case of LaCl3:Ln(3+) Yeung YY, Tanner PA
6317 - 6325	Visible Light-Driven Artificial Molecular Switch Actuated by Radical-Radical and Donor-Acceptor Interactions Sun JL, Wu YL, Liu ZC, Cao D, Wang YP, Cheng CY, Chen DY, Wasielewski MR, Stoddart JF
6326 - 6332	Probing the Hydrogen-Bonded Water Network at the Active Site of a Water Oxidation Catalyst: [Ru(bpy)(tpy)(H2O)](2+)center dot(H2O)(0-4) Duffy EM, Marsh BM, Garand E
6333 - 6338	Moving in on the Action: An Experimental Comparison of Fluorescence Excitation and Photodissociation Action Spectroscopy Wellman SMJ, Jockusch RA
6339 - 6345	Modeling the Charging of Highly Oxidized Cyclohexene Ozonolysis Products Using Nitrate-Based Chemical Ionization Hyttinen N, Kupiainen-Maatta O, Rissanen MP, Muuronen M, Ehn M, Kurten T
6346 - 6353	CO2 Absorption in an Alcoholic Solution of Heavily Hindered Alkanolamine: Reaction Mechanism of 2-(tert-Butylamino)ethanol with CO2 Revisited Xie HB, Wei XX, Wang P, He N, Chen JW
6354 - 6369	Molecular Dynamics Study of the Photodesorption of CO Ice van Hemert MC, Takahashi J, van Dishoeck EF
6370 - 6376	C9H8 Pyrolysis. o-Tolylacetylene, Indene, 1-Indenyl, and Biindenyls and the Mechanism of Indene Pyrolysis Wentrup C, Winter HW, Kvaskoff D
6377 - 6390	Ab Initio Kinetics of Hydrogen Abstraction from Methyl Acetate by Hydrogen, Methyl, Oxygen, Hydroxyl, and Hydroperoxy Radicals Tan T, Yang XL, Krauter CM, Ju YG, Carter EA
6391 - 6403	Hydration, Orientation, and Conformation of Methylglyoxal at the Air-Water Interface Wren SN, Gordon BP, Valley NA, McWilliams LE, Richmond GL
6404 - 6411	Theoretical Investigation on Mechanistic and Kinetic Transformation of 2,2',4,4',5-Pentabromodiphenyl Ether Cao HJ, Han DD, Li MY, Li X, He MX, Wang WX
6412 - 6420	Chemical Descriptors of Yttria-Stabilized Zirconia at Low Defect Concentration: An ab Initio Study Parkes MA, Refson K, d'Ayezac M, Offer GJ, Brandon NP, Harrison NM
6421 - 6427	Ab Initio Comparison of Bonding Environments and Threshold Behavior in GexAs10Se90-x and GexSb10Se90-x Glass Models Opletal G, Drumm DW, Petersen TC, Wang RP, Russo SP
6428 - 6435	Dielectric and Conduction Mechanisms of Parylene N at High Temperature: Phase-Transition Effect Kachroudi A, Kahouli A, Legrand J, Jomni F
6436 - 6445	Toward the Prediction of Water Exchange Rates in Magnetic Resonance Imaging Contrast Agents: A Density Functional Theory Study Regueiro-Figueroa M, Platas-Iglesias C
6446 - 6467	Structure and Energetics of Complexes of B12N12 with Hydrogen Halides-SAPT(DFT) and MP2 Study Yourdkhani S, Korona T, Hadipour NL
6468 - 6474	Atomic Zero Steric Potential and the Regioselectivity of Reactions Noorizadeh S, Shajirati M
6475 - 6482	High-Field Electron Paramagnetic Resonance and Density Functional Theory Study of Stable Organic Radicals in Lignin: Influence of the Extraction Process, Botanical Origin, and Protonation Reactions on the Radical g Tensor Bahrle C, Nick TU, Bennati M, Jeschke G, Vogel F
6483 - 6492	Structure and Properties of Polyfluoride F-n(-) Clusters (n=3-29) Gutsev GL, Belay KG, Weatherford CA, Ramachandran BR, Gutsev LG, Jena P
6493 - 6503	Structures, Thermochemical Properties, and Bonding of Mixed Alkaline-Earth-Metal Silicon Trimers Si3M+/0/- with M = Be, Mg, Ca Hang TD, Hung HM, Nguyen HT, Nguyen MT
6504 - 6515	Assessing the Performance of the Diffusion Monte Carlo Method As Applied to the Water Monomer, Dimer, and Hexamer Mallory JD, Brown SE, Mandelshtam VA
6516 - 6527	Kinetics and Thermodynamics of the Reaction between the (OH)-O-center dot Radical and Adenine: A Theoretical Investigation Milhoj BO, Sauer SPA
6528 - 6541	Bonding Motifs of Noble-Gas Compounds As Described by the Local Electron Energy Density Borocci S, Giordani M, Grandinetti F
6542 - 6550	Kinetic Stability of Non-IPR Fullerene Molecular Ions Aihara J, Nakagami Y, Sekine R
6551 - 6562	Ab Initio Screening Approach for the Discovery of Lignin Polymer Breaking Pathways Mar BD, Qi HW, Liu F, Kulik HJ
6563 - 6573	Why trans- or cis-Dimethyl Fumarate Addition to 2,5-Dimethylpyrrole Gives Exclusively trans-7-Azanorbornane Wang MA, Luo H, Zhang M, Wang JY
6574 - 6581	Dispersion Corrected Structural Properties and Quasiparticle Band Gaps of Several Organic Energetic Solids Appalakondaiah S, Vaitheeswaran G, Lebegue S