Journal of Physical Chemistry A

Journal of Physical Chemistry A, Vol.115, No.38 Entire volume, number list

ISSN: 1089-5639 (Print)

In this Issue (31 articles)

10383 - 10390	UV Photodissociation Dynamics of Deprotonated 2'-Deoxyadenosine 5'-Monophosphate [5'-dAMP-H](-) Kumar SS, Perot-Taillandier M, Lucas B, Soorkia S, Barat M, Fayeton JA
10391 - 10397	Aluminum Avoids the Central Position in AlB9- and AlB10-: Photoelectron Spectroscopy and ab Initio Study Li WL, Romanescu C, Galeev TR, Wang LS, Boldyrev AI
10398 - 10407	How Does the Urea Dynamics Differ from Water Dynamics inside the Reverse Micelle? Sengupta A, Khade RV, Hazra P
10408 - 10415	Size of Free Neutral CO2 Clusters from Carbon 1s Ionization Energies Harnes J, Winkler M, Lindblad A, Saethre LJ, Borve KJ
10416 - 10422	Infrared Spectra of the C2H2-(OCS)(2) van der Waals Complex: Observation of a Structure with C-2 Symmetry Rezaei M, McKellar ARW, Moazzen-Ahmadi N
10423 - 10432	Simulated Annealing and Density Functional Theory Calculations of Structural and Energetic Properties of the Ammonium Chloride Clusters (NH4Cl)(n), (NH4+)(NH4Cl)(n), and (Cl-)(NH4Cl)(n), n=1-13 Topper RQ, Feldmann WV, Markus IM, Bergin D, Sweeney PR
10433 - 10437	The Ammonia-Hydrogen System under Pressure Chidester BA, Strobel TA
10438 - 10444	Structural Evolution during Evaporation of a 3-Glycidoxypropyltrimethoxysilane Film Studied in Situ by Time Resolved Infrared Spectroscopy Innocenzi P, Figus C, Takahashi M, Piccinini M, Malfatti L
10445 - 10451	Initial Excited-State Structural Dynamics of 2'-Deoxyguanosine Determined via UV Resonance Raman Spectroscopy El-Yazbi AF, Palech A, Loppnow GR
10452 - 10460	Photophysical Investigation of Neutral and Diprotonated Free-Base Bis(Arylethynyl)porphyrins Goldberg PK, Pundsack TJ, Splan KE
10461 - 10469	Infrared Photodissociation Spectroscopy of Copper Carbonyl Cations Brathwaite AD, Reed ZD, Duncan MA
10470 - 10490	Kinetic Modeling of Ethane Pyrolysis at High Conversion Xu C, Al Shoaibi AS, Wang CG, Carstensen HH, Deant AM
10491 - 10501	Thermal Dehydration of Monohydrocalcite: Overall Kinetics and Physico-geometrical Mechanisms Kimura T, Koga N
10502 - 10510	Structures, Energies, and Spin-Spin Coupling Constants of Methyl-Substituted 1,3-Diborata-2,4-diphosphoniocyclobutanes: Four-member B-P-B-P Rings B2P2(CH3)(n)H8-n, with n=0, 1, 2, 4 Del Bene JE, Alkorta I, Elguero J
10511 - 10516	The O-H Stretching Mode of a Prototypical Photoacid as a Local Dielectric Probe Premont-Schwarz M, Xiao DQ, Batista VS, Nibbering ETJ
10517 - 10526	Aqueous-Phase OH Oxidation of Glyoxal: Application of a Novel Analytical Approach Employing Aerosol Mass Spectrometry and Complementary Off-Line Techniques Lee AKY, Zhao R, Gao SS, Abbatt JPD
10527 - 10538	Determination of Equilibrium Constants for the Reaction between Acetone and HO2 Using Infrared Kinetic Spectroscopy Grieman FJ, Noell AC, Davis-Van Atta C, Okumura M, Sander SP
10539 - 10549	Atmospheric Chemistry of (Z)-CF3CH=CHCF3: OH Radical Reaction Rate Coefficient and Global Warming Potential Baasandorj M, Ravishankara AR, Burkholder JB
10550 - 10555	New Generation of Dialkylsilylenes with Stabilities Comparable to Diaminosilylenes: A Theoretical Study Momeni MR, Shakib FA, Azizi Z
10556 - 10564	Coordination of Methanol Clusters to Benzene: A Computational Study Matisz G, Kelterer AM, Fabian WMF, Kunsagi-Mate S
10565 - 10575	Role of Metal Ions in the Destruction of TATP: Theoretical Considerations Dubnikova F, Kosloff R, Oxley JC, Smith JL, Zeiri Y
10576 - 10586	Group Additivity Values for Estimating the Enthalpy of Formation of Organic Compounds: An Update and Reappraisal. 1. C, H, and O Holmes JL, Aubry C
10587 - 10595	Validating Affinities for Ion-Lipid Association from Simulation against Experiment Klasczyk B, Knecht V
10596 - 10599	Electron and Hydrogen Transfer in Small Hydrogen Fluoride Anion Clusters Bai X, Ning M, Brown RE
10600 - 10609	Raman Spectroscopic Study of the Tautomeric Composition of Adenine in Water Burova TG, Ermolenkov VV, Ten GN, Shcherbakov RS, Baranov VI, Lednev IK
10610 - 10616	On the Shock Sensitivity of Explosive Compounds with Small-Scale Gap Test Tan BS, Long XP, Peng RF, Li HB, Jin B, Chu SJ
10617 - 10623	NMR Shielding Constants in PH3, Absolute Shielding Scale, and the Nuclear Magnetic Moment of P-31 Lantto P, Jackowski K, Makulski W, Olejniczak M, Jaszunski M
10624 - 10637	Electronic Structure, Molecular Electrostatic Potentials, Vibrational Spectra in Substituted Calix[n]arenes (n=4, 5) from Density Functional Theory Khedkar JK, Pinjari RV, Gejji SP
10638 - 10649	Structure and NMR Spectra of Some [2.2]Paracyclophanes. The Dilemma of [2.2]Paracyclophane Symmetry Dodziuk H, Szymanski S, Jazwinski J, Ostrowski M, Demissie TB, Ruud K, Kus P, Hopf H, Lin ST
10650 - 10654	Frequency Upshift in BO2 and CO2+ upon Electronic Excitation: A Twin-State Model Rationalization Zilberg S, Haas Y
10655 - 10663	First-Principle Calculations on the Microscopic Fe-57 Electric-Field-Gradient Tensor of Ferrous Chloride Tetrahydrate: A Prototypical Mossbauer Species Bull JN, Maclagan RGAR, Tennant WC