Journal of Physical Chemistry A

Journal of Physical Chemistry A, Vol.113, No.5 Entire volume, number list

ISSN: 1089-5639 (Print)

In this Issue (23 articles)

791 - 796	First Principles Study on the Diffusion of Alkali-Metal Ions on the Armchair Single-Wall Nanotubes Li J, Li HM, Liang XQ, Zhang SO, Zhao T, Xia DG, Wu ZY
797 - 799	Spectroscopy of Protonated Peptides Assisted by Infrared Multiple Photon Excitation Guidi M, Lorenz UJ, Papadopoulos G, Boyarkin OV, Rizzo TR
800 - 804	Ab Initio Molecular Dynamics Study of the Electronic Structure of Superoxide Radical Anion in Solution Li JC, Hou H, Wang BS
805 - 810	Relaxation in the Triplet Manifold of 1-Nitronaphthalene Observed by Transient Absorption Spectroscopy Zugazagoitia JS, Collado-Fregoso E, Plaza-Medina EF, Peon J
811 - 823	Experimental and Theoretical Exploration of the Initial Steps in the Decomposition of a Model Nitramine Energetic Material: Dimethylnitramine Bhattacharya A, Guo YQ, Bernstein ER
824 - 832	Structures of Hydrated Li+-Thymine and Li+-Uracil Complexes by IRMPD Spectroscopy in the N-H/O-H Stretching Region Gillis EAL, Rajabi K, Fridgen TD
833 - 838	Numerical Investigation of Photochemical Behavior in Bromate-1,4-Cyclohexanedione Reactions Li N, Zhang YH, Wang JC
839 - 844	Integral Absorption Coefficients of C-H Stretching Bands in IR Spectra of Ethane Adsorbed by Cationic Forms of Y Zeolite Subbotina IR, Kazansky VB, Krohnert J, Jentoft FC
845 - 851	Dimeric Complexes of Tryptophan with M2+ Metal Ions Dunbar RC, Steill JD, Polfer NC, Oomens J
852 - 857	Rate Constants for the Gas-Phase Reactions of OH Radicals with a Series of C-6-C-14 Alkenes at 299 +/- 2 K Nishino N, Arey J, Atkinson R
858 - 865	Rate Coefficients for the Gas-Phase Reactions of OH and NO3 Radicals and O-3 with Ethyleneglycol Monovinyl Ether, Ethyleneglycol Divinyl Ether, and Diethyleneglycol Divinyl Ether Zhou SM, Barnes I, Zhu T, Benter T
866 - 868	Deciphering Chemical Bonding in Golden Cages Zubarev DY, Boldyrev AI
869 - 877	A Self-Starting Method for Obtaining Analytic Potential-Energy Surfaces from ab Initio Electronic Structure Calculations Agrawal PM, Malshe M, Narulkar R, Raff LM, Hagan M, Bukkapatnum S, Komanduri R
878 - 886	Effects of Heteroatoms on Aromatic pi-pi Interactions: Benzene-Pyridine and Pyridine Dimer Hohenstein EG, Sherrill CD
887 - 894	Perfluorinated Polycyclic Aromatic Hydrocarbons: Anthracene, Phenanthrene, Pyrene, Tetracene, Chrysene, and Triphenylene Feng XJ, Li QS, Gu JD, Cotton FA, Xie YM, Schaefer HF
895 - 901	Calculations of the Relative Energies of the Low-Lying Electronic States of 2-Methylenedihydrophenalene-1,3-diyl: Effects of a 1,8-Naphtho Bridging Group on Trimethylenemethane and of a Vinylidene Bridging Group on 1,8-Naphthoquinodimethane Dong H, Hrovat DA, Quast H, Borden WT
902 - 911	Characterizing Slight Structural Disorder in Solids by Combined Solid-State NMR and First Principles Calculations Cadars S, Lesage A, Pickard CJ, Sautet P, Emsley L
912 - 916	Stability of Superoxide Ion in Imidazolium Cation-Based Room-Temperature Ionic Liquids Islam MM, Imase T, Okajima T, Takahashi M, Niikura Y, Kawashima N, Nakamura Y, Ohsaka T
917 - 923	Theoretical Study of Ethylbenzenium Ions: The Mechanism for Splitting Off Ethene, and the Formation of a pi Complex of Ethene and the Benzenium Ion Kolboe S, Svelle S, Arstad B
924 - 930	pi-Stack Dimers of Small Polyaromatic Hydrocarbons: A Path to the Packing of Graphenes Yurtsever E
931 - 937	Flexibility of the Saturated Five-Membered Ring in 2,5-Pyrrolidinedione (Succinimide): Electron Diffraction and Quantum-Chemical Studies with Use of Vibrational Spectroscopy Data Vogt N, Khaikin LS, Grikina OE, Karasev NM, Vogt J, Vilkov LV
938 - 942	What Makes the Huge P-31-P-31 Coupling Constants in S(PF2)(2) and Se(PF2)(2) Vary So Much with Temperature? Reilly AM, Wann DA, Rankin DWH
943 - 944	Classification of Dynamic Vibronic Couplings in Vibrational Real-Time Spectra of a Thiophene Derivative by Few-Cycle Pulses (vol 111, pg 12985, 2007) Kobayashi T, Wang ZA, Otsubo T