[ASAP] Theory of Electrochemical Proton-Coupled Electron Transfer in Diabatic Vibronic Representation: Application to Proton Discharge on Metal Electrodes in Alkaline Solution

The Journal of Physical Chemistry CDOI: 10.1021/acs.jpcc.0c08096

7h

[ASAP] Efficient Calculation of Small Molecule Binding in Metal–Organic Frameworks and Porous Organic Cages

The Journal of Physical Chemistry CDOI: 10.1021/acs.jpcc.0c08617

7h

[ASAP] Effect of Surface Energy on Shearing of Metal Asperities Contact at the Nanoscale

The Journal of Physical Chemistry CDOI: 10.1021/acs.jpcc.0c06371

7h

[ASAP] Improving the Plasmonic Response of Silver Nanoparticle Arrays via Atomic Layer Deposition Coating and Annealing above the Melting Point

The Journal of Physical Chemistry CDOI: 10.1021/acs.jpcc.0c09112

7h

[ASAP] Sulfur-Driven Transition from Vertical to Lateral Growth of 2D SnS–SnS₂ Heterostructures and Their Band Alignments

The Journal of Physical Chemistry CDOI: 10.1021/acs.jpcc.0c09101

7h

[ASAP] Enabling High Dielectric Response in PVDF/V₂C MXene–TiO₂ Composites Based on Nontypical V–F–Ti Bonding and Fermi-Level Overlapping Mechanisms

The Journal of Physical Chemistry CDOI: 10.1021/acs.jpcc.0c08444

11h

[ASAP] Dehydrogenation and Rehydrogenation of Ammonia Borane under Shock Loading: Ab Initio Molecular Dynamics Simulations

The Journal of Physical Chemistry CDOI: 10.1021/acs.jpcc.0c07748

11h

[ASAP] Improving the Description of Interlayer Bonding in TiS₂ by Density Functional Theory

The Journal of Physical Chemistry CDOI: 10.1021/acs.jpcc.0c09460

11h

[ASAP] Revealing the Structural Reversibility of High-Performance Surface-Enhanced NVOPF Cathode Materials for Sodium Ion Batteries

The Journal of Physical Chemistry CDOI: 10.1021/acs.jpcc.0c08654

15h

[ASAP] Plasmonic Properties of Metallic Nanoshells in the Quantum Limit: From Single Particle Excitations to Plasmons

The Journal of Physical Chemistry CDOI: 10.1021/acs.jpcc.0c10507

19h