J. Phys. Chem. A
latest articles published in The Journal of Physical Chemistry A
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First-Principles Study of Molecular Hydrogen Adsorption and Dissociation on AlnCr (n = 1–13) Clusters
Categories: American Chemical Society
Path-Branching Representation for Nonadiabatic Electron Dynamics in Conical Intersection
Categories: American Chemical Society
Theoretical Studies of the Ground and Excited State Structures of Stilbene
Categories: American Chemical Society
Similarity in Dissymmetry Factor Spectra: A Quantitative Measure of Comparison between Experimental and Predicted Vibrational Circular Dichroism
Categories: American Chemical Society
High-Resolution Spectroscopy of C3 around 3 μm
Categories: American Chemical Society
Radicals in the Bray–Liebhafsky Oscillatory Reaction
Categories: American Chemical Society
On the Nature of Hypercoordination in Dihalogenated Perhalocyclohexasilanes
Categories: American Chemical Society
A Computational Study of Detoxification of Lewisite Warfare Agents by British Anti-lewisite: Catalytic Effects of Water and Ammonia on Reaction Mechanism and Kinetics
Categories: American Chemical Society
Phenylbenzoxazole–Amide–Cyclen Linkage as a Ratiometric Fluorescent Receptor for Zn(II) in Water
Categories: American Chemical Society
Interpretation and Application of Reaction Class Transition State Theory for Accurate Calculation of Thermokinetic Parameters Using Isodesmic Reaction Method
Categories: American Chemical Society
Rate Coefficients for Vibrational Relaxation of OH(X2Π, v = 1–4) by He
Categories: American Chemical Society
Study of Interaction between NO Radicals and Martin’s Spirosilane by Means of IR Spectroscopy
Categories: American Chemical Society
Oxidation of CO by Nickel Oxide Clusters Revealed by Post Heating
Categories: American Chemical Society
Microwave Studies on 1,4-Pentadiene: CH2CH–CH2–CHCH2; Transformations among the Three Rotational Isomers
Categories: American Chemical Society
Theoretical Insight for the Metal Insertion Pathway of Endohedral Alkali Metal Fullerenes
Categories: American Chemical Society
Effect of Light-Induced Conical Intersection on the Photodissociation Dynamics of the D2+ Molecule
Categories: American Chemical Society
Solvent-Mediated Vibrational Energy Relaxation from Vaska’s Complex Adducts in Binary Solvent Mixtures
Categories: American Chemical Society
Rotation and Rotation–Vibration Spectroscopy of the 0+–0– Inversion Doublet in Deuterated Cyanamide
Categories: American Chemical Society
Coordination of N,N-Chelated Re(CO)3Cl Units Across a Mo2 Quadruple Bond: Synthesis, Characterization, and Photophysical Properties of a Re–Mo2–Re Triad and Its Component Pieces
Categories: American Chemical Society
Direct Dynamics Simulations of the Product Channels and Atomistic Mechanisms for the OH– + CH3I Reaction. Comparison with Experiment
Categories: American Chemical Society