Journal of Chemical Physics

Metastable states assisted homogeneous nucleation in supercooled liquid aluminum alloys: Insights from a phenomenologically coupled atomistic, phase-field, and machine learning investigation.

Ab initio spin-mapping non-adiabatic dynamics simulations of photochemistry.

Research on PVDF/BNNSs/MXene multilayer films with high energy density and thermal conductivity for dielectric capacitors.

Bridge connectivity effects on photoinduced ground-state electron spin polarization.

Perturbative spin-orbit couplings for the simulation of extended framework materials.

Peptide classification from statistical analysis of nanopore sensing experiments.

Metastable states assisted homogeneous nucleation in supercooled liquid aluminum alloys: Insights from a phenomenologically coupled atomistic, phase-field, and machine learning investigation.

Ab initio spin-mapping non-adiabatic dynamics simulations of photochemistry.

Research on PVDF/BNNSs/MXene multilayer films with high energy density and thermal conductivity for dielectric capacitors.

Bridge connectivity effects on photoinduced ground-state electron spin polarization.

Perturbative spin-orbit couplings for the simulation of extended framework materials.

Peptide classification from statistical analysis of nanopore sensing experiments.