Journal of Physical Chemistry A

Journal of Physical Chemistry A, Vol.121, No.22 Entire volume, number list

ISSN: 1089-5639 (Print)

In this Issue (19 articles)

4203 - 4217	Initiation Reactions in Acetylene Pyrolysis Zador J, Fellows MD, Miller JA
4218 - 4224	Thermal Decomposition of Nitromethane and Reaction between CH3 and NO2 Matsugi A, Shiina H
4225 - 4232	Protonation-Induced Room-Temperature Phosphorescence in Fluorescent Polyurethane Sun W, Wang ZW, Wang T, Yang L, Jiang J, Zhang XY, Luo Y, Zhang GQ
4233 - 4241	Fragmentation of Valence and Core-Shell (CI 2p) Excited C2Cl4 Molecule Santos ACF, MacDonald MA, Rocha AB, Appathurai N, Sant'Anna MM, Holetz W, Wehlitz R, Zuin L
4242 - 4252	Self-Assembled Ruthenium(II)Porphyrin-Aluminium(III)Porphyrin-Fullerene Triad for Long-Lived Photoinduced Charge Separation Amati A, Cavigli P, Kahnt A, Indelli MT, Iengo E
4253 - 4262	Quantum Chemical Investigation on Photochemical Reactions of Nonanoic Acids at Air-Water Interface Xiao P, Wang Q, Fang WH, Cui GL
4263 - 4271	Characterization of the Isothermal Compression Behavior of LLM-172 Ciezak-Jenkins JA, Borstad GM, Batyrev IG
4272 - 4282	Mechanistic Description of Photochemical Oligomer Formation from Aqueous Pyruvic Acid Rapf RJ, Perkins RJ, Carpenter BK, Vaida V
4283 - 4295	Role of the C(2)-H Hydrogen Bond Donor in Gas-Phase Microsolvation of Imidazole Derivatives with ROH (R = CH3, C2H5) Bhattacherjee A, Wategaonkar S
4296 - 4305	Infrared Spectra of Neutral Bent Carbon Dioxide Grebenshchikov SY
4306 - 4317	Structural and Optical Properties of Subporphyrinoids: A TD-DFT Study Azarias C, Pawelek M, Jacquemin D
4318 - 4325	Role of Proton Tunneling and Metal-Free Organocatalysis in the Decomposition of Methanediol: A Theoretical Study Kumar M, Anglada JM, Francisco JS
4326 - 4333	Electrochemical Oxidation of Phenolic Compounds at Boron-Doped Diamond Anodes: Structure-Reactivity Relationships Jiang Y, Zhu XP, Xing X
4334 - 4340	Accurate Anharmonic Zero-Point Energies for Some Combustion-Related Species from Diffusion Monte Carlo Harding LB, Georgievskii Y, Klippenstein SJ
4341 - 4351	Predicting Chemical Reactivity from the Charge Density through Gradient Bundle Analysis: Moving beyond Fukui Functions Morgenstern A, Wilson TR, Eberhart ME
4352 - 4362	A Computational Exploration of H2S and CO2 Capture by Ionic Liquids Based on alpha-Amino Acid Anion and N-7,N-9-Dimethyladeninium Cation Seyedhosseini B, Izadyar M, Housaindokht MR
4363 - 4371	Diels-Alder Cycloaddition of Cyclopentadiene and C-60 at the Extreme High Pressure Yang T, Fukuda R, Cammi R, Ehara M
4372 - 4378	Possible Formation of H3O+ Cations Due to Aluminum Fluoride Interactions with Water Wilenska D, Skurski P, Anusiewicz I
4379 - 4387	Efficient DLPNO CCSD(T)-Based Estimation of Formation Enthalpies for C-, H-, O-, and N-Containing Closed-Shell Compounds Validated Against Critically Evaluated Experimental Data Paulechka E, Kazakov A