J. Phys. Chem. A
Table of Contents for The Journal of Physical Chemistry A. List of articles from both the latest and ahead of print issues.
Updated: 54 min 35 sec ago
Tetrahedral Ordering in Water: Raman Profiles and Their Temperature Dependence†
The Journal of Physical Chemistry A, Volume 0, Issue 0, Articles ASAP (As Soon As Publishable).Categories: ACS journal feeds
UV Absorption Spectrum of the ClO Dimer (Cl2O2) between 200 and 420 nm
The Journal of Physical Chemistry A, Volume 0, Issue 0, Articles ASAP (As Soon As Publishable).Categories: ACS journal feeds
Theoretical Study on the Photochemical Behavior of 4-Dimethylamino-4′-cyanodiphenylacetylene
The Journal of Physical Chemistry A, Volume 0, Issue 0, Articles ASAP (As Soon As Publishable).Categories: ACS journal feeds
Breakdown of the Hume−Rothery Rules in Sub-Nanometer-Sized Ta-Containing Bimetallic Small Clusters
The Journal of Physical Chemistry A, Volume 0, Issue 0, Articles ASAP (As Soon As Publishable).Categories: ACS journal feeds
Molecular Symmetry Properties of Conical Intersections and Nonadiabatic Coupling Terms: Theory and Quantum Chemical Demonstration for Cyclopenta-2,4-dienimine (C5H4NH)†
The Journal of Physical Chemistry A, Volume 0, Issue 0, Articles ASAP (As Soon As Publishable).Categories: ACS journal feeds
Quantum Dynamics at the State-to-State Level of the C + OH Reaction on the First Excited Potential Energy Surface†
The Journal of Physical Chemistry A, Volume 0, Issue 0, Articles ASAP (As Soon As Publishable).Categories: ACS journal feeds
Covalent vs Electrostatic Interactions in Rare Earth Systems: A Comparative Study of U(III), U(IV), and U(V) and Nd(III) Bonding Properties by DFT and CAS-PT2 Approaches†
The Journal of Physical Chemistry A, Volume 0, Issue 0, Articles ASAP (As Soon As Publishable).
Categories: ACS journal feeds
Energy Barriers of Vinylidene Carbene Reactions from the Anti-Hermitian Contracted Schrödinger Equation
The Journal of Physical Chemistry A, Volume 0, Issue 0, Articles ASAP (As Soon As Publishable).
Categories: ACS journal feeds
Water Dimer Radical Cation: Structures, Vibrational Frequencies, and Energetics
The Journal of Physical Chemistry A, Volume 0, Issue 0, Articles ASAP (As Soon As Publishable).Categories: ACS journal feeds
Relativistic Double-Zeta, Triple-Zeta, and Quadruple-Zeta Basis Sets for the 4s, 5s, 6s, and 7s Elements†
The Journal of Physical Chemistry A, Volume 113, Issue 45, Page 12638-12644, November 12, 2009.
Categories: ACS journal feeds
Large-Scale Parallel Uncontracted Multireference-Averaged Quadratic Coupled Cluster: The Ground State of the Chromium Dimer Revisited†
The Journal of Physical Chemistry A, Volume 113, Issue 45, Page 12729-12740, November 12, 2009.
Categories: ACS journal feeds
Chemical Bonding in the N2 Molecule and the Role of the Quantum Mechanical Interference Effect†
The Journal of Physical Chemistry A, Volume 113, Issue 45, Page 12541-12548, November 12, 2009.
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On the Validity of the Born−Oppenheimer Separation and the Accuracy of Diagonal Corrections in Anharmonic Molecular Vibrations†
The Journal of Physical Chemistry A, Volume 113, Issue 45, Page 12461-12469, November 12, 2009.
Categories: ACS journal feeds
Resonant X-ray Enhancement of the Auger Effect in High-Z Atoms, Molecules, and Nanoparticles: Potential Biomedical Applications†
The Journal of Physical Chemistry A, Volume 113, Issue 45, Page 12356-12363, November 12, 2009.
Categories: ACS journal feeds
Interactions of Dimethylsulfoxide with a Dipalmitoylphosphatidylcholine Monolayer Studied by Vibrational Sum Frequency Generation†
The Journal of Physical Chemistry A, Volume 113, Issue 45, Page 12655-12662, November 12, 2009.Categories: ACS journal feeds
Theoretical Study on the f−f Transition Intensities of Lanthanide Trihalide Systems†
The Journal of Physical Chemistry A, Volume 113, Issue 45, Page 12615-12625, November 12, 2009.
Categories: ACS journal feeds
Benchmarking Electronic Structure Calculations on the Bare UO22+ Ion: How Different are Single and Multireference Electron Correlation Methods?†
The Journal of Physical Chemistry A, Volume 113, Issue 45, Page 12504-12511, November 12, 2009.
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O(3P) + C2H4 Potential Energy Surface: Study at the Multireference Level†
The Journal of Physical Chemistry A, Volume 113, Issue 45, Page 12663-12674, November 12, 2009.
Categories: ACS journal feeds
Ab Initio Characterization of C6†
The Journal of Physical Chemistry A, Volume 113, Issue 45, Page 12404-12410, November 12, 2009.
Categories: ACS journal feeds
Study of the Mechanism of the N−CO Photodissociation in N,N-Dimethylformamide by Direct Trajectory Surface Hopping Simulations†
The Journal of Physical Chemistry A, Volume 113, Issue 45, Page 12582-12590, November 12, 2009.Categories: ACS journal feeds