화학공학소재연구정보센터

Journal of Physical Chemistry A

Journal of Physical Chemistry A, Vol.117, No.48 Entire volume, number list
ISSN: 1089-5639 (Print) 

In this Issue (38 articles)

12677 - 12692 Predictive Theory for the Addition and Insertion Kinetics of (CH2)-C-1 Reacting with Unsaturated Hydrocarbons
Polino D, Klippenstein SJ, Harding LB, Georgievskii Y
12693 - 12702 Kinetics and Mechanism of the Oxidation of N-Acetyl Homocysteine Thiolactone with Aqueous Iodine and Iodate
Sexton A, Mbiya W, Morakinyo MK, Simoyi RH
12703 - 12710 Thermal Rate Constants for the O(P-3) + HBr and O(P-3) + DBr Reactions: Transition-State Theory and Quantum Mechanical Calculations
de Oliveira AGS, Ornellas FR, Peterson KA, Mielke SL
12711 - 12718 Interaction of a Pair of Parallel Scroll Waves
Kupitz D, Hauser MJB
12719 - 12725 Propagating Precipitation Waves: Experiments and Modeling
Tinsley MR, Collison D, Showalter K
12726 - 12733 Effect of Temperature and Substitution on Cope Rearrangement: A Symmetry Perspective
Tuvi-Arad I, Rozgonyi T, Stirling A
12734 - 12748 Ionic and Tautomeric Composition of Cytosine in Aqueous Solution: Resonance and Non-Resonance Raman Spectroscopy Study
Burova TG, Ermolenkov VV, Ten GN, Kadrov DM, Nurlygaianova MN, Baranov VI, Lednev IK
12749 - 12758 Photophysics and Luminescence Spectroelectrochemistry of [Tc(dmpe)(3)](+/2+) (dmpe=1,2-bis(dimethylphosphino)ethane)
Chatterjee S, Del Negro AS, Smith FN, Wang ZM, Hightower SE, Sullivan BP, Heineman WR, Seliskar CJ, Bryan SA
12759 - 12769 Dinitrogen Release from Arylpentazole: A Picosecond Time-Resolved Infrared, Spectroelectrochemical, and DFT Computational Study
Portius P, Davis M, Campbell R, Hartl F, Zeng Q, Meijer AJHM, Towrie M
12770 - 12782 Theoretical Modeling of Deuteration-Induced Shifts of the 0-0 Bands in Absorption Spectra of Selected Aromatic Amines: The Role of the Double-Well Potential
Andrzejak M, Kolek P
12783 - 12795 Theoretical Insight into the Inelastic Electron Tunneling Spectra of an Anil Derivative
Segerie A, Liegeois V, Champagne B, Lin LL, Luo Y
12796 - 12801 Ultrafast Relaxation Dynamics of Uracil Probed via Strong Field Dissociative Ionization
Matsika S, Spanner M, Kotur M, Weinacht TC
12802 - 12811 Absorption Spectrum and Absolute Absorption Cross Sections of CH3O2 Radicals and CH3I Molecules in the Wavelength Range 7473-7497 cm(-1)
Farago EP, Viskolcz B, Schoemaecker C, Fittschen C
12812 - 12820 High Resolution Electronic Spectroscopy of Vibrationally Hot Bands of Benzimidazole
Brand C, Rolf J, Wilke M, Schmitt M
12821 - 12830 Theoretical Investigation of Phosphinidene Oxide Polypyridine Ruthenium(II) Complexes: Toward the Design of a New Class of Photochromic Compounds
Vieuxmaire OPJ, Piau RE, Alary F, Heully JL, Sutra P, Igau A, Boggio-Pasqua M
12831 - 12841 Jet-Cooled Fluorescence Spectroscopy of a Natural Product: Anethole
Barber VP, Newby JJ
12842 - 12850 Microhydration Effects on the Electronic Properties of Protonated Phenol: A Theoretical Study
Ataelahi M, Omidyan R
12851 - 12857 Ultrafast Excited-State Dynamics and Vibrational Cooling of 8-Oxo-7,8-dihydro-2'-deoxyguanosine in D2O
Zhang YY, Dood J, Beckstead A, Chen JQ, Li XB, Burrows CJ, Lu Z, Matsika S, Kohler B
12858 - 12867 Redox Modulation of para-Phenylenediamine by Substituted Nitronyl Nitroxide Groups and Their Spin States
Ito A, Kurata R, Sakamaki D, Yano S, Kono Y, Nakano Y, Furukawa K, Kato T, Tanaka K
12868 - 12877 Enabling Forbidden Processes: Quantum and Solvation Enhancement of Nitrate Anion UV Absorption
Svoboda O, Kubelova L, Slavicek P
12878 - 12883 Volume Increment Effect on the Photoisomerization of Hemicyanine Dyes in Oligo(ethylene glycol)s
Lee Y, Lee M
12884 - 12888 State-Selective Excitation of the CO Stretch in Carboxyhemoglobin by Mid-IR Laser Pulse Shaping: A Theoretical Investigation
Debnath A, Falvo C, Meier C
12889 - 12896 Effects of Reagent Rotation and Vibration on H plus OH (v, j)-> O + H-2
Li XH, Arasa C, van Hemert MC, van Dishoeck EF
12897 - 12911 Mineral Oxides Change the Atmospheric Reactivity of Soot: NO2 Uptake under Dark and UV Irradiation Conditions
Romanias MN, Bedjanian Y, Zaras AM, Andrade-Eiroa A, Shahla R, Dagaut P, Philippidis A
12912 - 12921 Oligomerization Reaction of the Criegee Intermediate Leads to Secondary Organic Aerosol Formation in Ethylene Ozonolysis
Sakamoto Y, Inomata S, Hirokawa J
12922 - 12929 In Situ Real Time Infrared Spectroscopy of Sorption of (Poly)molybdate Ions into Layered Double Hydroxides
Davantes A, Lefevre G
12930 - 12945 Experimental and Theoretical Study of Aqueous cis-Pinonic Acid Photolysis
Lignell H, Epstein SA, Marvin MR, Shemesh D, Gerber RB, Nizkorodov S
12946 - 12952 Molecular Recognition of Aromatic Rings by Flavin: Electrostatics and Dispersion Determine Ring Positioning above Isoalloxazine
Koziol L, Kumar N, Wong SE, Lightstone FC
12953 - 12958 Orbital Localization Criterion as a Complementary Tool in the Bonding Analysis by Means of Electron Localization Function: Study of the Si-n(BH)(5-n)(2-) (n=0-5) Clusters
Ona OB, Alcoba DR, Torre A, Lain L, Torres-Vega JJ, Tiznado W
12959 - 12968 Enhancing Effects of Electron-Withdrawing Groups and Metallic Ions on Halogen Bonding in the YC6F4X center dot center dot center dot C2H8N2 (X = Cl, Br, I; Y = F, CN, NO2, LiNC+, NaNC+) Complex
Han N, Zeng YL, Li XY, Zheng SJ, Meng LP
12969 - 12982 Accurate Determination of the Deformation of the Benzene Ring upon Substitution: Equilibrium Structures of Benzonitrile and Phenylacetylene
Rudolph HD, Demaison J, Csaszar AG
12983 - 12989 Dielectric Constant of Polyhydric Alcohol-DMSO Mixture Solution at the Microwave Frequency
Qian J, Jia GZ
12990 - 12997 Interaction of Glycine with Common Atmospheric Nucleation Precursors
Elm J, Fard M, Bilde M, Mikkelsen KV
12998 - 13008 Probing the Structural, Bonding, and Magnetic Properties of Cobalt Coordination Complexes: Co-Benzene, Co-Pyridine, and Co-Pyrimidine
Shao P, Kuang XY, Ding LP
13009 - 13017 Trifluoromethylation of Fullerenes: Kinetic and Thermodynamic Control
Ignat'eva DV, Goryunkov AA, Ioffe IN, Sidorov LN
13018 - 13024 Pnicogen Bonds: A Theoretical Study Based on the Laplacian of Electron Density
Eskandari K, Mahmoodabadi N
13025 - 13036 Magnetic Superatoms in VLin (n=1-13) Clusters: A First-Principles Prediction
Zhang M, Zhang JF, Feng XJ, Zhang HY, Zhao LX, Luo YH, Cao W
13037 - 13037 Photochemical Properties of Mono-, Tri-, and Penta-Cationic Antimony(V) Metalloporphyrin Derivatives on a Clay Layer Surface (vol 117, pg 7823, 2013)
Tsukamoto T, Shimada T, Takagi S