J. Phys. Chem. A
latest articles published in The Journal of Physical Chemistry A
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Photoelectron Spectroscopic and Theoretical Study of Aromatic–Bim Anionic Complexes (Aromatic = C6H5, C5H4N, C4H3O, and C4H4N; m = 1–3): A Comparative Study
Categories: American Chemical Society
Two-Color Two-Dimensional Electronic Spectroscopy Using Dual Acousto-Optic Pulse Shapers for Complete Amplitude, Phase, and Polarization Control of Femtosecond Laser Pulses
Categories: American Chemical Society
High-Level ab Initio Investigations on Structures and Energetics of N2O Clusters
Categories: American Chemical Society
Density Functional Theory Calculations of the Redox Potentials of Actinide(VI)/Actinide(V) Couple in Water
Categories: American Chemical Society
Investigation of the Structure and Spectroscopy of H5+ Using Diffusion Monte Carlo
Categories: American Chemical Society
Differences in the Sublimation Energy of Benzene and Hexahalogenbenzenes Are Caused by Dispersion Energy
Categories: American Chemical Society
High-Accuracy Estimates for the Vinylidene-Acetylene Isomerization Energy and the Ground State Rotational Constants of :CCH2
Categories: American Chemical Society
High Level ab Initio Calculations for ClFn+ (n = 1–6) Ions: Refining the Recoupled Pair Bonding Model
Categories: American Chemical Society
Robust Magnetic Moments on Impurities in Metallic Clusters: Localized Magnetic States in Superatoms
Categories: American Chemical Society
Chemical Shift Changes and Line Narrowing in 13C NMR Spectra of Hydrocarbon Clathrate Hydrates
Categories: American Chemical Society
Energy-Resolved Collision-Induced Dissociation Studies of 1,10-Phenanthroline Complexes of the Late First-Row Divalent Transition Metal Cations: Determination of the Third Sequential Binding Energies
Categories: American Chemical Society
Variational Calculation of Highly Excited Rovibrational Energy Levels of H2O2
Categories: American Chemical Society
Dissociative Chemisorption of Methane on Pt(110)-(1×2): Effects of Lattice Motion on Reactions at Step Edges
Categories: American Chemical Society
Theoretical and Kinetic Study of the Reactions of Ketones with HȮ2 Radicals. Part I: Abstraction Reaction Channels
Categories: American Chemical Society
Molecular Mechanisms in the Pyrolysis of Unsaturated Chlorinated Hydrocarbons: Formation of Benzene Rings. 2. Experimental and Kinetic Modeling Studies
Categories: American Chemical Society
Molecular Mechanisms in the Pyrolysis of Unsaturated Chlorinated Hydrocarbons: Formation of Benzene Rings. 1. Quantum Chemical Studies
Categories: American Chemical Society
Structure-H Methane + 1,1,2,2,3,3,4-Heptafluorocyclopentane Mixed Hydrate at Pressures up to 373 MPa
Categories: American Chemical Society
Formation of HCN+ in Heterogeneous Reactions of N2+ and N+ with Surface Hydrocarbons
Categories: American Chemical Society
Kinetics and Thermodynamics of Atmospherically Relevant Aqueous Phase Reactions of α-Pinene Oxide
Categories: American Chemical Society
Quantum Dynamics Study of the F + CH4 → HF + CH3 Reaction on an Ab Initio Potential Energy Surface
Categories: American Chemical Society