[ASAP] Hydride Affinities for Main-Group Hydride Reductants: Assessment of Density Functionals and Trends in Reactivities

The Journal of Physical Chemistry ADOI: 10.1021/acs.jpca.0c10543

2d

[ASAP] Charge Transfer and Spin Dynamics in a Zinc Porphyrin Donor Covalently Linked to One or Two Naphthalenediimide Acceptors

The Journal of Physical Chemistry ADOI: 10.1021/acs.jpca.0c10471

2d

[ASAP] 1,3-Dipolar Cycloadditions by a Unified Perspective Based on Conceptual and Thermodynamics Models of Chemical Reactivity

The Journal of Physical Chemistry ADOI: 10.1021/acs.jpca.0c10013

2d

[ASAP] Uncertainty of High Temperature Heat Capacities: The Case Study of the NH Radical

The Journal of Physical Chemistry ADOI: 10.1021/acs.jpca.0c09512

2d

[ASAP] A Magnetic Superatomic Dimer with an Intense Internal Electric Dipole Moment

The Journal of Physical Chemistry ADOI: 10.1021/acs.jpca.0c10262

3d

[ASAP] Elusive Magnetic Compounds Originated from Planar Tetracoordinate Silicon, a Theoretical Prediction

The Journal of Physical Chemistry ADOI: 10.1021/acs.jpca.0c10544

3d

[ASAP] Theoretical Engineering of Singlet Fission Kinetics in Perylene Bisimide Dimer with Chromophore Rotation

The Journal of Physical Chemistry ADOI: 10.1021/acs.jpca.0c08706

4d

[ASAP] Soft X-ray Induced Production of Neutral Fragments in High-Rydberg States at the O 1s Ionization Threshold of the Water Molecule

The Journal of Physical Chemistry ADOI: 10.1021/acs.jpca.0c06940

5d

[ASAP] Tracing the Coherent Manipulation of Rotational Dynamics by Shaped Femtosecond Pulse-Induced Two-Dimensional Rotational Coherent Spectrum

The Journal of Physical Chemistry ADOI: 10.1021/acs.jpca.0c09244

5d

[ASAP] Effect of Polymerization on the Charge-Transfer Mechanism in the One (Two)-Photon Absorption Process of D–A-Type Triphenylamine Derivatives

The Journal of Physical Chemistry ADOI: 10.1021/acs.jpca.0c09309

5d