Journal of Physical Chemistry A

Journal of Physical Chemistry A, Vol.120, No.46 Entire volume, number list

ISSN: 1089-5639 (Print)

In this Issue (26 articles)

9131 - 9137	Low-Temperature Disproportionation Reaction of NO on Au-6(-): A Mechanism Involving Three NO Molecules Promoted by the Negative Charge Ma J, Cao XZ, Chen MY, Yin BQ, Xing XP, Wang XF
9138 - 9150	Reactions of Atomic Carbon with Butene Isomers: Implications for Molecular Growth in Carbon-Rich Environments Bourgalais J, Spencer M, Osborn DL, Goulay F, Le Picard SD
9151 - 9158	Computational Mechanistic Study of Redox-Neutral Rh(III)-Catalyzed C-H Activation Reactions of Arylnitrones with Alkynes: Role of Noncovalent Interactions in Controlling Selectivity Xing YY, Liu JB, Tian YY, Sun CZ, Huang F, Chen DZ
9159 - 9169	LIF Spectroscopy of p-Fluorophenol center dot center dot center dot Water Complex: Hydrogen Bond Vibrations, Fermi Resonance, and Vibrational Relaxation in the Excited State Mukhopadhyay DP, Biswas S, Chakraborty T
9170 - 9177	Studies on GeF4 Valence and Rydberg States by Electron Impact Spectroscopy and Ab lnitio Calculations Ohtomi S, Hoshino M, Suga A, Kato H, Duflot D, Limao-Vieira P, Tanaka H
9178 - 9187	Two-Photon-Excited Fluorescence-Encoded Infrared Spectroscopy Mastron JN, Tokmakoff A
9188 - 9197	Dissociative Photoionization of 1-Halogenated Silacyclohexanes: Silicon Traps the Halogen Bodi A, Sigurdardottir KL, Kvaran A, Bjornsson R, Arnason I
9198 - 9202	Ab Initio Investigation of the Ground States of F2P(S)N, F2PNS, and F2PSN Moon J, Baek H, Kim J
9203 - 9208	Stepwise Internal Energy Change of Protonated Methanol Clusters By Using the Inert Gas Tagging Shimamori T, Kuo JL, Fujii A
9209 - 9216	Locating the Proton in Nicotinamide Protomers via Low-Resolution UV Action Spectroscopy of Electrosprayed Solutions Matthews E, Dessent CEH
9217 - 9223	Symmetry-Dependent Intramolecular Charge Transfer Dynamics of Pyrene Derivatives Investigated by Two-Photon Excitation Lee S, Kim D
9224 - 9234	Carboxylate Ion Availability at the Air-Water Interface Enami S, Fujii T, Sakamoto Y, Hama T, Kajii Y
9235 - 9243	Predicting the Strength of Anion-pi Interactions of Substituted Benzenes: the Development of Anion-pi Binding Substituent Constants Bagwill C, Anderson C, Sullivan E, Manohara V, Murthy P, Kirkpatrick CC, Stalcup A, Lewis M
9244 - 9248	Ab Initio Modeling Of Friction Reducing Agents Shows Quantum Mechanical Interactions Can Have Macroscopic Manifestation Velazquez JDH, Barroso-Flores J, Goicochea AG
9249 - 9256	Uncommon and Emissive {[Au-2(C3H6NS2)(2)][Au(C3H6NS2)(2)](2)(PF6)(2)} Mixed Au+ and Au3+ Pseudotetranuclear Crystalline Compound: Synthesis, Structural Characterization, and Optical Properties Langaro AP, Souza AKR, Morassuti CY, Lima SM, Casagrande GA, Deflon VM, Nunes LAO, Andrade LHD
9257 - 9269	Design, Synthesis, and Structural Characterization of a Bisantimony(III) Compound for Anion Binding and the Density Functional Theory Evaluation of Halide Binding through Antimony Secondary Bonding Interactions Qiu JC, Unruh DK, Cozzolino AF
9270 - 9280	Dispersion Effects on the Thermodynamics and Transition States of Dimethylarsinic Acid Adsorption on Hydrated Iron (Oxyhydr)oxide Clusters from Density Functional Theory Calculations Adamescu A, Hamilton IP, Al-Abadleh HA
9281 - 9291	Can Systematic Molecular Fragmentation Be Applied to Direct Ab Initio Molecular Dynamics? Collins MA
9292 - 9298	Symmetry-Adapted Perturbation Theory Energy Analysis of Alkyl Fluorine-Aromatic Interactions in Torsion Balance Systems Sherman MC, Ams MR, Jordan KD
9299 - 9304	Restricted-Open-Shell G4(MP2)-Type Procedures Chan B, Karton A, Raghavachari K, Radom L
9305 - 9314	Halogen-pi Interactions between Benzene and X-2/CX4 (X = Cl, Br): Assessment of Various Density Functionals with Respect to CCSD(T) Youn IS, Kim DY, Cho WJ, Madridejos JML, Lee HM, Kolaski M, Lee J, Baig C, Shin SK, Filatov M, Kim KS
9315 - 9323	Computational Study of Ways by Which exo-Silatranes Might Be Prepared Hoeksema C, Adler MJ, Gilbert TM
9324 - 9329	Quantum Mechanical Identification of Quadrupolar Plasmonic Excited States in Silver Nanorods Gieseking RL, Ratner MA, Schatz GC
9330 - 9340	Second-Order Nonlinear Optical Properties of Carboranylated Square-Planar Pt(II) Zwitterionic Complexes: One-/Two-Dimensional Difference and Substituent Effect Wang HQ, Wang L, Li RR, Ye JT, Chen ZZ, Chen H, Qiu YQ, Xie HM
9341 - 9347	Diabatization for Time-Dependent Density Functional Theory: Exciton Transfers and Related Conical Intersections Tamura H
9348 - 9351	Strategies for Evaluation of Rys Roots and Weights King HF