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The Journal of Physical Chemistry A: Latest Articles (ACS Publications)
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Last updated about 3 years ago
[ASAP] Carbon Condensation via [4 + 2] Cycloaddition of Highly Unsaturated Carbon Chains
over 3 years ago
The Journal of Physical Chemistry ADOI: 10.1021/acs.jpca.3c00617
[ASAP] Optimization of General Molecular Properties in the Equilibrium Geometry Using Quantum Alchemy: An Inverse Molecular Design Approach
over 3 years ago
The Journal of Physical Chemistry ADOI: 10.1021/acs.jpca.3c00205
[ASAP] Investigating the Association Reactions of HOCH2CO and HOCHCHO with O2: A Quantum Computational and Master Equation Study
over 3 years ago
The Journal of Physical Chemistry ADOI: 10.1021/acs.jpca.2c08163
[ASAP] Structures of (Pyrazine)2 and (Pyrazine)(Benzene) Dimers Investigated with Infrared–Vacuum Ultraviolet Spectroscopy and Quantum-Chemical Calculations: Competition among π–π, CH···π, and CH···N Interactions
over 3 years ago
The Journal of Physical Chemistry ADOI: 10.1021/acs.jpca.3c01767
[ASAP] Insights into the Reduction Mechanisms of Np(VI) to Np(V) by Carbohydrazide
over 3 years ago
The Journal of Physical Chemistry ADOI: 10.1021/acs.jpca.3c00062
[ASAP] The Surprising Ease of Finding Optimal Solutions for Controlling Nonlinear Phenomena in Quantum and Classical Complex Systems
over 3 years ago
The Journal of Physical Chemistry ADOI: 10.1021/acs.jpca.3c01896
[ASAP] Excited States, Symmetry Breaking, and Unphysical Solutions in State-Specific CASSCF Theory
over 3 years ago
The Journal of Physical Chemistry ADOI: 10.1021/acs.jpca.3c00603
[ASAP] Predicting the Melting Point of Energetic Molecules Using a Learnable Graph Neural Fingerprint Model
over 3 years ago
The Journal of Physical Chemistry ADOI: 10.1021/acs.jpca.3c00112
[ASAP] Compressive Symbol: A New Way to Evaluate the High-Pressure Behaviors of Energetic Tetrazole Materials
over 3 years ago
The Journal of Physical Chemistry ADOI: 10.1021/acs.jpca.3c00423
[ASAP] A General Path–Integral Monte Carlo Method for Exact Simulations of Chemical Reaction Networks
over 3 years ago
The Journal of Physical Chemistry ADOI: 10.1021/acs.jpca.3c01064
[ASAP] Characterization of Oxidation Products from HOCl Uptake by Microhydrated Methionine Anions Using Cryogenic Ion Vibrational Spectroscopy
over 3 years ago
The Journal of Physical Chemistry ADOI: 10.1021/acs.jpca.3c00509
[ASAP] Mechanistic Understanding and Reactivity Analyses for the Photochemistry of Disubstituted Tetrazoles
over 3 years ago
The Journal of Physical Chemistry ADOI: 10.1021/acs.jpca.3c01594