Journal of Physical Chemistry A

Journal of Physical Chemistry A, Vol.124, No.39 Entire volume, number list

ISSN: 1089-5639 (Print)

In this Issue (26 articles)

7857 - 7868	Ultrafast Singlet Fission and Intersystem Crossing in Halogenated Tetraazaperopyrenes Wollscheid N, Gunther B, Rao VJ, Berger FJ, Lustres JLP, Motzkus M, Zaumseil J, Gade LH, Hofener S, Buckup T
7869 - 7880	Phonon Spectroscopy in Antimony and Tellurium Oxides Jafari A, Klobes B, Sergueev I, Moseley DH, Manley ME, Dronskowski R, Deringer VL, Stoffel RP, Bessas D, Chumakov AI, Ruffer R, Mahmoud A, Bridges CA, Daemen LL, Cheng YQ, Ramirez-Cuesta AJ, Hermann RP
7881 - 7892	Molecular-Weight Growth in Ozone-Initiated Low-Temperature Oxidation of Methyl Crotonate He X, Hansen N, Moshammer K
7893 - 7900	Proton Transfer Reaction Rates in Phenol-Ammonia Cluster Cation Tachikawa H, Iyama T
7901 - 7910	Ab Initio-Based Global Potential Energy Surface and Reaction Dynamics for H2S + C Masoumpour MS, Daryanavard M
7911 - 7926	Kinetic Study of the Reactions PO + O-2 and PO2 + O-3 and Spectroscopy of the PO Radical Douglas KM, Blitz MA, Mangan TP, Western CM, Plane JMC
7927 - 7934	In-Depth Ab Initio Study of Thermally Activated Delayed Fluorescence in 4,5-Di(9H-carbazol-9-yl)-phthalonitrile Freidzon AY, Bagaturyants AA
7935 - 7942	Low-Temperature Oxidation of Hydrogen Sulfide and Formaldehyde Pollutants in Humid Air by UV Radiation at 184.95 and 253.65 nm Bryukov MG, Vasilyak LM, Vasiliev AI, Kostyuchenko SV, Kudryavtsev NN
7943 - 7949	Triplet Exciton Transfers and Triplet-Triplet Annihilation in Anthracene Derivatives via Direct versus Superexchange Pathways Governed by Molecular Packing Tamura H
7950 - 7958	Rate Constants of the CN plus Toluene Reaction from 15 to 294 K and Interstellar Implications Messinger JP, Gupta D, Cooke IR, Okumura M, Sims IR
7959 - 7965	Below Band Gap Formation of Solvated Electrons in Neutral Water Clusters? Ban LR, West CW, Chasovskikh E, Gartmann TE, Yoder BL, Signorell R
7966 - 7972	Role of Spin in the Catalytic Oxidation of CO by N2O Enabled by Co+: New Insights from Temperature-Dependent Kinetics and Statistical Modeling McDonald DC, Sweeny BC, Viggiano AA, Shuman NS, Ard SG
7973 - 7990	Topological Ring-Currents and Bond-Currents in Hexaanionic Altans and Iterated Altans of Corannulene and Coronene Dickens TK, Mallion RB
7991 - 7998	Reaction Mechanism of CO2 and Styrene Oxide Catalyzed by Ionic Liquids: A Combined DFT Calculation and Experimental Study Zha JY, Ding T, Chen J, Wang R, Gao GH, Xia F
7999 - 8004	Intramolecular Dispersion Attraction in Tetraalkylammonium Cations Revealed by Cryogenic Ion Mobility Mass Spectrometry Ohshimo K, Sato R, Misaizu F
8005 - 8010	Adsorption and Dissociation of Ni(acac)(2) on Iron by Ab Initio Calculations Corsini C, Peeters S, Righi MC
8011 - 8018	A Theoretical Study of the Recently Suggested Mn-VII Mechanism for O-O Bond Formation in Photosystem II Li XC, Li J, Siegbahn PEM
8019 - 8028	The Effect of Solvent-Substrate Noncovalent Interactions on the Diastereoselectivity in the Intramolecular Carbonyl-Ene and the Staudinger [2+2] Cycloaddition Reactions Jain S, Vanka K
8029 - 8039	Ionization Energy and Reduction Potential in Ferrocene Derivatives: Comparison of Hybrid and Pure DFT Functionals Toma M, Kuvek T, Vrcek V
8040 - 8049	Unraveling the Hidden Role of the Counteranion in "Cation in a Cage" Systems Mukherjee A, Ghule S, Tiwari MK, Vanka K
8050 - 8056	Pyrolysis of Triclosan and Its Chlorinated Derivatives Narimani M, da Silva G
8057 - 8064	Plasmon-Resonant Vibrational Sum Frequency Generation of Electrochemical Interfaces: Direct Observation of Carbon Dioxide Electroreduction on Gold Wallentine S, Bandaranayake S, Biswas S, Baker LR
8065 - 8078	Multifidelity Statistical Machine Learning for Molecular Crystal Structure Prediction Egorova O, Hafizi R, Woods DC, Day GM
8079 - 8087	Charge-Transfer Excitation Energies Expressed as Orbital Energies of Kohn-Sham Density Functional Theory with Long-Range Corrected Functionals Hirao K, Chan B, Song JW, Bae HS
8088 - 8099	Multireaction Approach to Quantum Thermochemistry Irikura KK
8100 - 8100	State-Resolved Dissociation and Exchange Reactions in CO2 Flows (vol 123, pg 10529, 2019) Kustova E, Savelev A, Armenise I