The Journal of Physical Chemistry A

Title Publication Date Language Citations
Issue Publication Information2023/07/13English
Addressing the Embeddability Problem in Transition Rate Estimation2023/06/28English
Issue Editorial Masthead2023/06/29English
Issue Publication Information2023/06/29English
Systematic Tuning of Electronic Ground and Excited States in Donor–Acceptor Dyes; Steps toward Designer Compounds for Modern Technologies2023/06/13English
Effects of Solvent Dielectric on Thermally Activated Delayed Fluorescence: A Predictive Computational Polarization Consistent Approach2022/12/23English
Electronic State Spectroscopy of Nitromethane and Nitroethane2023/02/02English
Issue Publication Information2023/02/02English
Issue Editorial Masthead2023/02/02English
The CH–3Σ+ Anion: Inelastic Rate Coefficients from Collisions with He at Interstellar Conditions2023/01/04English
Vector Correlations in the 225 nm Photodissociation of Co(CO)3NO2023/01/03English
Pyridinium-Inspired Organocatalysts for Carbon Dioxide Fixation: A Density Functional Theory Inspection2023/01/03English
Theoretical Spectroscopic Study of Normal Raman and Charge Transfer Surface-Enhanced Raman Scattering (SERS) Spectra of the Adsorbed l- and d-Cysteine on the Chiral Au34 and Ag4@Au30 Nanoclusters: Chirality Discrimination2024/04/17English
Issue Editorial Masthead2024/04/18English
Theoretical Investigation on Dialumenes toward Dihydrogen Activation: Mechanism and Ligand Effect2024/04/18English
A Method for Predicting the Melting Temperature of Ionic Compounds2024/04/18English
Issue Publication Information2024/04/18English
Collection on the Spectroscopy, Structure, and Reactivity of Stabilized Criegee Intermediates2024/04/18English
Theoretical Investigation on the H Atom Abstraction Reaction from C1–C4 Alkanes and Alkenes by ṄH2 Radicals2024/04/18English
Unraveling the Rich Fragmentation Dynamics Associated with S–H Bond Fission Following Photoexcitation of H2S at Wavelengths ∼129.1 nm2024/04/23English
Probing the Electronic Structure of [B10H10]2– Dianion Encapsulated by an Octamethylcalix[4]pyrrole Molecule2024/04/23English
Theoretical Insights into the Photophysical Properties of 4CzIPN Doped in Different Hosts: A Multiscale Study2024/04/22English
Dirac–Coulomb–Breit Molecular Mean-Field Exact-Two-Component Relativistic Equation-of-Motion Coupled-Cluster Theory2024/04/23English
Spectroscopic Characterization of Hydrogen-Bonded 2,7-Diazaindole Water Complex Isolated in the Gas Phase2024/04/23English
Microscopic Mechanism for Further NO Heterogeneous Reduction by Potassium-Doped Biochar: A DFT Study2024/04/23English
Flexible Ansatz for N-Body Perturbation Theory2024/04/23English
Operator Formulation of Feynman Path Centroid Dynamics for Rotations2024/04/23English
Argentophilic Interactions, Flexibility, and Dynamics of Pyrrole Cages Encapsulating Silver(I) Clusters2024/04/23English
Identification of Two Stable Side-Chain Orientations of Valine Methyl Ester by Microwave Spectroscopy2024/04/17English
Thermochemistry of Gas-Phase Thermal Oxidation of C2 to C8 Perfluorinated Sulfonic Acids with Extrapolation to C162024/04/16English