most citedUltrafast Photochemistry and Electron Diffraction for Cyclobutanone in the S2 State: Surface Hopping with Time-Dependent Density Functional Theory

10 citations · 10 across the 1 of their papers we have counts for

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1 paper

physics.chem-ph2024★ 10 cited

Ultrafast Photochemistry and Electron Diffraction for Cyclobutanone in the S2 State: Surface Hopping with Time-Dependent Density Functional Theory

Ericka Roy Miller, Sean J. Hoehn, Abhijith Kumar +2

We simulate the photodynamics of gas-phase cyclobutanone excited to the S state using fewest switches surface hopping (FSSH) dynamics powered by time-dependent density function…