화학공학소재연구정보센터

Journal of Physical Chemistry A

Journal of Physical Chemistry A, Vol.117, No.40 Entire volume, number list
ISSN: 1089-5639 (Print) 

In this Issue (47 articles)

10145 - 10150 Thermally and Chemically Stable Mixed Valence Copper Oxide Cluster Ions Revealed by Post Heating
Morita K, Sakuma K, Miyajima K, Mafune F
10151 - 10161 Theoretical Study of Gas Hydrate Decomposition Kinetics-Model Development
Windmeier C, Oellrich LR
10162 - 10169 Isoconversional Kinetic Analysis of Decomposition of Nitroimidazoles: Friedman method vs Flynn-Wall-Ozawa Method
Venkatesh M, Ravi P, Tewari SP
10170 - 10177 Bond Cleavage During Isobutanol Thermal Decomposition and the Breaking of C-C Bonds in Alcohols at High Temperatures
Rosado-Reyes C, Tsang W
10178 - 10185 Reactions of Fe+ and FeO+ with C2H2, C2H4, and C2H6: Temperature-Dependent Kinetics
Ard SG, Melko JJ, Fournier JA, Shuman NS, Viggiano AA
10186 - 10195 High-Temperature Shock Tube and Modeling Studies on the Reactions of Methanol with D-Atoms and CH3-Radicals
Peukert SL, Michael JV
10196 - 10210 Substituent Effect on the Photoreduction Kinetics of Benzophenone
Demeter A, Horvath K, Boor K, Molnar L, Soos T, Lendvay G
10211 - 10217 Advanced Nanocluster Ion Source Based on High-Power Impulse Magnetron Sputtering and Time-Resolved Measurements of Nanocluster Formation
Zhang CH, Tsunoyama H, Akatsuka H, Sekiya H, Nagase T, Nakajima A
10218 - 10227 Quantum Chemical and Kinetics Study of the Thermal Gas Phase Decomposition of 2-Chloropropene
Tucceri ME, Badenes MP, Cobos CJ
10228 - 10238 Direct Measurements of Rate Constants for the Reactions of CH3 Radicals with C2H6, C2H4, and C2H2 at High Temperatures
Peukert SL, Labbe NJ, Sivaramakrishnan R, Michael JV
10239 - 10247 Substituent Effects on Dynamics at Conical Intersections: Cycloheptatrienes
Schalk O, Boguslavskiy AE, Schuurman MS, Brogaard RY, Unterreiner AN, Wrona-Piotrowicz A, Werstiuk NH, Stolow A
10248 - 10259 Conformational Space and Photochemistry of Tyramine Isolated in Argon and Xenon Cryomatrixes
Giuliano BM, Melandri S, Reva I, Fausto R
10260 - 10273 Intramolecular Interactions in 2-Aminoethanol and 3-Aminopropanol
Thomsen DL, Axson JL, Schroder SD, Lane JR, Vaida V, Kjaergaard HG
10274 - 10285 Effect of Hydrogen Bond Formation on the NMR Properties of Glycine-HCN Complexes
da Silva AM, Ghosh A, Chaudhuri P
10286 - 10293 Chemiluminescence Evidence Supporting the Selective Role of Ligands in the Permanganate Oxidation of Micropollutants
Roderick MS, Adcock JL, Terry JM, Smith ZM, Parry S, Linton SM, Thornton MT, Barrow CJ, Francis PS
10294 - 10303 Intramolecular Charge Transfer and Solvation Dynamics of Thiolate-Protected Au-20(SR)(16) Clusters Studied by Ultrafast Measurement
Zhou M, Vdovic S, Long SR, Zhu MZ, Yan LY, Wang YY, Niu YL, Wang XF, Guo QJ, Jin RC, Xia AD
10304 - 10310 Microwave Spectrum and Conformational Properties of 4-Isocyano-1-butyne (HC CCH2CH2N C)
Samdal S, Mollendal H, Guillemin JC
10311 - 10319 Mechanism of the Quenching of the Tris(bipyridine)ruthenium(II) Emission by Persulfate: Implications for Photoinduced Oxidation Reactions
Lewandowska-Andralojc A, Polyansky DE
10320 - 10332 Comparative Studies of Structural, Thermal, Optical, and Electrochemical Properties of Azines with Different End Groups with Their Azomethine Analogues toward Application in (Opto)Electronics
Sek D, Siwy M, Bijak K, Grucela-Zajac M, Malecki G, Smolarek K, Bujak L, Mackowski S, Schab-Balcerzak E
10333 - 10345 Triplet State Formation in Photoexcited Slip-Stacked Perylene-3,4:9,10-bis(dicarboximide) Dimers on a Xanthene Scaffold
Lefler KM, Brown KE, Salamant WA, Dyar SM, Knowles KE, Wasielewski MR
10346 - 10358 Influence of Humidity, Temperature, and Radicals on the Formation and Thermal Properties of Secondary Organic Aerosol (SOA) from Ozonolysis of beta-Pinene
Emanuelsson EU, Watne AK, Lutz A, Ljungstrom E, Hallquist M
10359 - 10367 Temperature-Dependent Henry's Law Constants of Atmospheric Organics of Biogenic Origin
Leng CB, Kish JD, Kelley J, Mach M, Hiltner J, Zhang YH, Liu Y
10368 - 10380 DRIFTS Studies on the Role of Surface Water in Stabilizing Catechol-Iron(III) Complexes at the Gas/Solid Interface
Tofan-Lazar J, Situm A, Al-Abadleh HA
10381 - 10396 Atmospheric Significance of Water Clusters and Ozone-Water Complexes
Anglada JM, Hoffman GJ, Slipchenko LV, Costa MM, Ruiz-Lopez MF, Francisco JS
10397 - 10406 Early Stages of Ti-O Cluster Growth on Carbon Nanotubes by ab Initio Calculations
Gialampouki MA, Lekka CE
10407 - 10415 H-2 Reactions on Palladium Clusters
Pelzer AW, Jellinek J, Jackson KA
10416 - 10427 Aerobic Oxidation of Methanol to Formic Acid on Au-8(-): Benchmark Analysis Based on Completely Renormalized Coupled-Cluster and Density Functional Theory Calculations
Hansen JA, Ehara M, Piecuch P
10428 - 10437 Syntheses, Structural, Computational, and Thermal Analysis of Acid-Base Complexes of Picric Acid with N-Heterocyclic Bases
Goel N, Singh UP
10438 - 10446 Improved ReaxFF Force Field Parameters for Au-S-C-H Systems
Bae GT, Aikens CM
10447 - 10454 Influence of Intramolecular f-f Interactions on Nuclear Spin Driven Quantum Tunneling of Magnetizations in Quadruple-Decker Phthalocyanine Complexes Containing Two Terbium or Dysprosium Magnetic Centers
Fukuda T, Matsumura K, Ishikawa N
10455 - 10461 Resonance Enhancement via Imidazole Substitution Predicts New Cation Receptors
Suresh CH, Sayyed FB
10462 - 10469 Unraveling the Origin of the Relative Stabilities of Group 14 M2N22+ (M, N = C, Si, Ge, Sn, and Pb) Isomer Clusters
Diaz-Cervantes E, Poater J, Robles J, Swart M, Sola M
10470 - 10476 Structure of the Thiolated Au-130 Cluster
Tlahuice-Flores A, Santiago U, Bahena D, Vinogradova E, Conroy CV, Ahuja T, Bach SBH, Ponce A, Wang GL, Jose-Yacaman M, Whetten RL
10477 - 10488 Superaromatic Stabilization Energy as a Novel Local Aromaticity, Index for Polycyclic Aromatic Hydrocarbons
Aihara J, Makino M, Sakamoto K
10489 - 10496 Systematic Theoretical Study of Non-nuclear Electron Density Maxima in Some Diatomic Molecules
Terrabuio LA, Teodoro TQ, Rachid MG, Haiduke RLA
10497 - 10503 Pnicogen Bonded Complexes of PO2X (X = F, Cl) with Nitrogen Bases
Alkorta I, Elguero J, Del Bene JE
10504 - 10512 Terahertz Vibrations of Crystalline Acyclic and Cyclic Diglycine: Benchmarks for London Force Correction Models
Juliano TR, Korter TM
10513 - 10525 Pump and Probe of Ultrafast Charge Reorganization in Small Peptides: A Computational Study through Sudden Ionizations
Kus T, Mignolet B, Levine RD, Remacle F
10526 - 10533 Electronic Structure and Optical Properties of the Thiolate-Protected Au-28(SMe)(20) Cluster
Knoppe S, Malola S, Lehtovaara L, Burgi T, Hakkinen H
10534 - 10543 Side Chain Flexibility in Perfluorosulfonic Acid Ionomers: An ab Initio Study
Clark JK, Paddison SJ
10544 - 10550 Experimental and Theoretical Studies on the Fragmentation of Gas-Phase Uranyl-, Neptunyl-, and Plutonyl-Diglycolamide Complexes
Gong Y, Hu HS, Rao LF, Li J, Gibson JK
10551 - 10562 Magnitude and Mechanism of Charge Enhancement of CH center dot center dot O Hydrogen Bonds
Adhikari U, Scheiner S
10563 - 10564 Comment on "Coherence and Uncertainty in Nanostructured Organic Photovoltaics"
Mukamel S
10565 - 10565 Reply to "Comment on'Coherence and Uncertainty in Nanostructured Organic Photovolatics'"
Kaake LG, Moses D, Heeger AJ
10566 - 10566 Polyradicals of Polycyclic Aromatic Hydrocarbons as Finite Size Models of Graphene: Highly Open-Shell Nature, Symmetry Breaking, and Enhanced-Edge Electron Density (vol 117, pg 8959, 2013)
Yadav A, Mishra PC
10567 - 10568 Effects of Roaming Trajectories on the Transition State Theory Rates of a Reduced-Dimensional Model of Ketene Isomerization (vol 117, pg 7553, 2013)
Ulusoy IS, Stanton JF, Hernandez R
10569 - 10569 Enthalpies of Formation of N-Substituted Pyrazoles and Imidazoles (vol 103, pg 9336, 1999)
Mo O, Yanez M, Roux MV, Jimenez P, Davalos JZ, da Silva MAVR, da Silva MDMCR, Matos MAR, Amaral LMPF, Sanchez-Migallon A, Cabildo P, Claramunt R, Elguero J, Liebman JF