Journal of Physical Chemistry A

Journal of Physical Chemistry A, Vol.116, No.22 Entire volume, number list

ISSN: 1089-5639 (Print)

In this Issue (28 articles)

5293 - 5298	Photoisomerization of cis-1-(3-Methyl-2-naphthyl)-2-phenylethene in Glassy Methylcyclohexane at 77 K Saltiel J, Hutchinson SR, Chitwood K, Dmitrenko O
5299 - 5304	Infrared Laser Spectroscopy of the CH3OO Radical Formed from the Reaction of CH3 and O-2 within a Helium Nanodroplet Morrison AM, Agarwal J, Schaefer HF, Douberly GE
5305 - 5311	Infrared Characterization of the HCOOH center dot center dot center dot CO2 Complexes in Solid Argon: Stabilization of the Higher-Energy Conformer of Formic Acid Tsuge M, Marushkevich K, Rasanen M, Khriachtchev L
5312 - 5316	Moisture Desorption Rates from TATB Formulations: Experiments and Kinetic Models Glascoe EA, Dinh LN, Small W, Overturf GE
5317 - 5324	Reaction of Methacrolein with the Hydroxyl Radical in Air: Incorporation of Secondary O-2 Addition into the MACR plus OH Master Equation da Silva G
5325 - 5336	Ultrafast Infrared and UV-Vis Studies of the Photochemistry of Methoxycarbonylphenyl Azides in Solution Xue JD, Luk HL, Eswaran SV, Hadad CM, Platz MS
5337 - 5348	Computational Study of Cyclohexanone-Monomer Co-initiation Mechanism in Thermal Homo-polymerization of Methyl Acrylate and Methyl Methacrylate Liu S, Srinivasan S, Grady MC, Soroush M, Rappe AM
5349 - 5352	Chiroptical Dissymmetries in Fluorescence Excitation from Single Molecules of (M-2) Helicene Dimers Cyphersmith A, Surampudi S, Casey MJ, Jankowski K, Venkataraman D, Barnes MD
5353 - 5367	Resolution of Conformer-Specific All-trans-1,6-diphenyl-1,3,5-hexatriene UV Absorption Spectra Turek AM, Saltiel J, Krishna TRS, Krishnamoorthy G
5368 - 5374	A Nine-Dimensional Calculation of the Vibrational OH Stretching and HOH Bending Spectrum of the Water Trimer Salmi T, Salli E, Halonen L
5375 - 5382	Photostereochemistry and Photoaquation Reactions of [Cr(tn)(3)](3+): Theoretical Studies Show the Importance of Reduced Coordination Conical Intersection Geometries Zurek JM, Paterson MJ
5383 - 5391	UV Spectroscopy of DNA Duplex and Quadruplex Structures in the Gas Phase Rosu F, Gabelica V, De Pauw E, Antoine R, Broyer M, Dugourd P
5392 - 5397	Theoretical Study on Photoisomerization Effect with a Reversible Nonlinear Optical Switch for Dithiazolylarylene Song P, Gao AH, Zhou PW, Chu TS
5398 - 5404	Photodissociation of Cobalt and Nickel Oxide Cluster Cations Dibble CJ, Akin ST, Ard S, Fowler CP, Duncan MA
5405 - 5409	Synthesis, High-Resolution Millimeter-Wave Spectroscopy, and Ab Initio Calculations of Ethylmercury Hydride Goubet M, Motiyenko RA, Margules L, Guillemin JC
5410 - 5419	How Many Chiral Centers Can Raman Optical Activity Spectroscopy Distinguish in a Molecule? Simmen B, Weymuth T, Reiher M
5420 - 5427	Computational Study on a HS- Sensing Reaction Utilizing a Pyrylium Derivative Sheng YH, Ren Y
5428 - 5435	Concentration Effects and Ion Properties Controlling the Fractionation of Halides during Aerosol Formation Guzman MI, Athalye RR, Rodriguez JM
5436 - 5444	Ionic Liquid Based on alpha-Amino Acid Anion and N7,N9-Dimethylguaninium Cation ([dMG][AA]): Theoretical Study on the Structure and Electronic Properties Shakourian-Fard M, Fattahi A, Bayat A
5445 - 5452	Formyloxyl Radical-Gold Nanoparticle Binding: A Theoretical Study Hull JM, Provorse MR, Aikens CM
5453 - 5463	Testing Computational Models of Hyperpolarizability in a Merocyanine Dye Using Spectroscopic and DFT Methods Reish ME, Kay AJ, Teshome A, Asselberghs I, Clays K, Gordon KC
5464 - 5471	Study of Specific Ion-Amino Acid Interactions through the Use of Local Correlation Methods Oliveira JCA, Feldt J, Galamba N, Mata RA
5472 - 5479	Characterizing Agosticity Using the Quantum Theory of Atoms in Molecules: Bond Critical Points and Their Local Properties Tognetti V, Joubert L, Raucoules R, De Bruin T, Adamo C
5480 - 5490	Competitive Role of CH4-CH4 and CH-pi Interactions in C6H6-(CH4)(n) Aggregates: The Transition from Dimer to Cluster Features Alberti M, Aguilar A, Lucas JM, Pirani F
5491 - 5496	Nature of Chemical Bonding and Metalloaromaticity of Na-2[(MArx')(3)] (M = B, Al, Ga; Arx' = C6H3-2,6-(C6H5)(2)) Li XY, Sun J, Zeng YL, Sun Z, Zheng SJ, Meng LP
5497 - 5500	Negative Electron Affinities from DFT: Influence of Asymptotic Exchange-Correlation Potential and Effective Homogeneity under Density Scaling Borgoo A, Tozer DJ
5501 - 5509	Enhancement of the Third-Order Nonlinear Optical Properties in Open-Shell Singlet Transition-Metal Dinuclear Systems: Effects of the Group, of the Period, and of the Charge of the Metal Atom Fukui H, Inoue Y, Yamada T, Ito S, Shigeta Y, Kishi R, Champagne B, Nakano M
5510 - 5517	How Do the Thiolate Ligand and Its Relative Position Control the Oxygen Activation in the Cysteine Dioxygenase Model? Che X, Gao J, Zhang DJ, Liu CB