J. Phys. Chem. A

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latest articles published in The Journal of Physical Chemistry A
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Strong Electronic Coupling Dominates the Absorption and Fluorescence Spectra of Covalently Bound BisBODIPYs

12 February, 2015 - 16:25

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The Journal of Physical Chemistry ADOI: 10.1021/acs.jpca.5b00637

Modeling Cusps in Adiabatic Potential Energy Surfaces

11 February, 2015 - 20:46

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The Journal of Physical Chemistry ADOI: 10.1021/jp512671q

Keto–Enol Tautomerism of Phenindione and Its Derivatives: An NMR and Density Functional Theory (DFT) Reinvestigation

11 February, 2015 - 19:13

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The Journal of Physical Chemistry ADOI: 10.1021/jp512461c

Temperature and Pressure Dependence of the Reaction S + CS (+M) → CS2 (+M)

11 February, 2015 - 11:42

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The Journal of Physical Chemistry ADOI: 10.1021/jp5121492

Mechanism of Samarium-Catalyzed 1,5-Regioselective Azide–Alkyne [3 + 2]-Cycloaddition: A Quantum Mechanical Investigation

11 February, 2015 - 05:11

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The Journal of Physical Chemistry ADOI: 10.1021/jp5104615

Experimental and Theoretical Study on the Thermal Decomposition of C3H6 (Propene)

10 February, 2015 - 20:39

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The Journal of Physical Chemistry ADOI: 10.1021/jp5102169

Relationship between Dipole Moments and Harmonic Vibrational Frequencies in Diatomic Molecules

10 February, 2015 - 20:39

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The Journal of Physical Chemistry ADOI: 10.1021/acs.jpca.5b00993

Ab Initio Study of the Reaction of Ozone with Bromide Ion

10 February, 2015 - 19:58

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The Journal of Physical Chemistry ADOI: 10.1021/jp5101279

Glyoxal Oxidation Mechanism: Implications for the Reactions HCO + O2 and OCHCHO + HO2

10 February, 2015 - 19:39

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The Journal of Physical Chemistry ADOI: 10.1021/jp512432q

Calculation of Solvation Free Energies with DCOSMO-RS

10 February, 2015 - 18:19

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The Journal of Physical Chemistry ADOI: 10.1021/jp511158y

Physical and Thermodynamic Properties of AlnCm Clusters: Quantum-Chemical Study

10 February, 2015 - 16:04

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The Journal of Physical Chemistry ADOI: 10.1021/jp5108087

VUV Photoionization Cross Sections of HO2, H2O2, and H2CO

10 February, 2015 - 14:18

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The Journal of Physical Chemistry ADOI: 10.1021/jp508942a

Prediction Uncertainty of Density Functional Approximations for Properties of Crystals with Cubic Symmetry

10 February, 2015 - 04:40

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The Journal of Physical Chemistry ADOI: 10.1021/jp509980w

Dissociative Photoionization of Quinoline and Isoquinoline

9 February, 2015 - 12:04

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The Journal of Physical Chemistry ADOI: 10.1021/jp5121993

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