Skip to main content
. 2020 Apr 20;11(10):3828–3834. doi: 10.1021/acs.jpclett.0c00527

Figure 3.

Figure 3

Quantum populations of populations up to 3000 fs of the thioformaldehyde molecule obtained from (A) 100 trajectories using CASSCF(6,5)/def2-SVP (QC) and (B) 9590 trajectories using SchNarc (ML).