화학공학소재연구정보센터

Journal of Physical Chemistry A

Journal of Physical Chemistry A, Vol.113, No.20 Entire volume, number list
ISSN: 1089-5639 (Print) 

In this Issue (29 articles)

5815 - 5822 Photoinduced Bond Dissociation of 4-Methylcoumarin Derivatives in Solution Studied by Laser Flash Photolysis and DFT Calculations
Yamaji M, Nozaki K, Allonas X, Nakajima S, Tero-Kubota S, Marciniak B
5823 - 5831 Methyl t-Butyl Ether and Methyl Trimethylsilyl Ether Ions Dissociate near Their Ionization Thresholds: A TPES, TPEPICO, RRKM, and G3 Investigation
Rennie EE, Cooper L, Shpinkova LG, Holland DMP, Shaw DA, Guest MF, Mayer PM
5832 - 5837 First Principles Investigation of H Addition and Abstraction Reactions on Doped Aluminum Clusters
Henry DJ, Varano A, Yarovsky I
5838 - 5845 Conformation-Specific Pathways of beta-Alanine: A Vacuum Ultraviolet Photoionization and Theoretical Study
Zhang LD, Pan Y, Guo HJ, Zhang TC, Sheng LS, Qi F, Lo PK, Lau KC
5846 - 5854 Photoinduced Electron Transfer in Porphyrin- and Fullerene/Porphyrin-Based Rotaxanes as Studied by Time-Resolved EPR Spectroscopy
Jakob M, Berg A, Rubin R, Levanon H, Li K, Schuster DI
5855 - 5864 Electron Super-Rich Radicals. III. On the Peculiar Behavior of the Aminodihydroxymethyl Radical in the Gas Phase
Gregersen JA, Hao CT, Turecek F
5865 - 5873 Computational Study on the Photophysics of Protonated Benzene
Rode MF, Sobolewski AL, Dedonder C, Jouvet C, Dopfer O
5874 - 5880 Messenger-Tagging Electrosprayed Ions: Vibrational Spectroscopy of Suberate Dianions
Goebbert DJ, Wende T, Bergmann R, Meijer G, Asmis KR
5881 - 5887 Nanosecond Time-Resolved and Steady-State Infrared Studies of Photoinduced Decomposition of TATB at Ambient and Elevated Pressure
Glascoe EA, Zaug JM, Armstrong MR, Crowhurst JC, Grant CD, Fried LE
5888 - 5895 Understanding Solvent Effects on Luminescent Properties of a Triple Fluorescent ESIPT Compound and Application for White Light Emission
Sun WH, Li SY, Hu R, Qian Y, Wang SQ, Yang GQ
5896 - 5905 Interaction of Hydrated Protons with Trioctylphosphine Oxide: NMR and Theoretical Study
Kriz J, Dybal J, Makrlik E, Budka J, Vanura P
5906 - 5911 Synthesis, Microwave Spectrum, and Conformational Equilibrium of Propa-1,2-dienethiol (H2C=C=CHSH)
Mollendal H, Khater B, Guillemin JC
5912 - 5917 Low Power Visible-to-UV Upconversion
Singh-Rachford TN, Castellano FN
5918 - 5926 Fluorinated Boroxin-Based Anion Receptors for Lithium Ion Batteries: Fluoride Anion Binding, Ab Initio Calculations, and Ionic Conductivity Studies
Nair NG, Blanco M, West W, Weise FC, Greenbaum S, Reddy VP
5927 - 5932 Blue Light Emitting Ir(III) Compounds for OLEDs - New Insights into Ancillary Ligand Effects on the Emitting Triplet State
Rausch AF, Thompson ME, Yersin H
5933 - 5941 Theoretical Study of Elementary Steps in the Reactions between Aluminum and Teflon Fragments under Combustive Environments
Losada M, Chaudhuri S
5942 - 5950 Estimations of Global Warming Potentials from Computational Chemistry Calculations for CH2F2 and Other Fluorinated Methyl Species Verified by Comparison to Experiment
Blowers P, Hollingshead K
5951 - 5957 Theoretical Investigation of the Reaction of CF3CHFOCH3 with OH Radical
Sun H, Gong HW, Pan XM, Hao LZ, Sun CC, Wang RS, Huang XR
5958 - 5965 OH-Initiated Degradation of Unsaturated Esters in the Atmosphere: Kinetics in the Temperature Range of 287-313 K
Blanco MB, Bejan I, Barnes I, Wiesen P, Teruel MA
5966 - 5971 Effect of Cage Charges on Multiphoton Absorptions: First-Principles Study on Metallofullerenes Sc2C2@C-68 and Sc3N@C-68
Cheng WD, Hu H, Wu DS, Wang JY, Huang SP, Xe Z, Zhang H
5972 - 5984 Investigation of Low-Lying States of Oxygen Molecule via Second-Order Multireference Perturbation Theory: A State-Specific Approach
Chattopadhyay S, Mahapatra US, Chaudhuri RK
5985 - 5992 Periodic Trends and Index of Boron Lewis Acidity
Plumley JA, Evanseck JD
5993 - 5997 Deciphering the NMR Fingerprints of the Disordered System with Quantum Chemical Studies
Ling Y, Zhang Y
5998 - 6003 A New Polymorph of N,N'-Dimethylurea Characterized by X-ray Diffraction and First-Principles Lattice Dynamics Calculations
Martins DMS, Spanswick CK, Middlemiss DS, Abbas N, Pulham CR, Morrison CA
6004 - 6015 Valence-Bond/Coherent-States Approach to the Charge Equilibration Model I. Valence-Bond Models for Diatomic Molecules
Morales JA
6016 - 6021 Polynomial-Time-Scaling Quantum Dynamics with Time-Dependent Quantum Monte Carlo
Christov IP
6022 - 6027 Spin-Polarized Structural, Electronic, and Magnetic Properties of Diluted Magnetic Semiconductors Cd1-xMnxS and Cd1-xMnxSe in Zinc Blende Phase
Nazir S, Ikram N, Tanveer M, Shaukat A, Saeed Y, Reshak AH
6028 - 6033 Rearrangements of [C6H7Si](+) Cations. A Radiochemical and Quantum Chemical Study
Ignatyev IS, Sundius T, Kochina TA, Avrorin VV, Sinotova EN
6034 - 6040 A Computational Study of Electronic and Spectroscopic Properties of Formic Acid Dimer Isotopologues
Malis M, Matanovic I, Doslic N