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physics.chem-ph2022★ 5 cited
Femtosecond intramolecular rearrangement of the CH3NCS radical cation
Jacob Stamm, Shuai Li, Bethany Jochim +4
Strong-field ionization, involving tunnel ionization and electron rescattering, enables femtosecond time-resolved dynamics measurements of chemical reactions involving radical cati…
physics.chem-ph2022★ 8 cited
Benchmarking the Semi-Stochastic CC(P;Q) Approach for Singlet-Triplet Gaps in Biradicals
Arnab Chakraborty, Stephen H. Yuwono, J. Emiliano Deustua +2
We recently proposed a semi-stochastic approach to converging high-level coupled-cluster (CC) energetics, such as those obtained in the CC calculations with singles, doubles, and t…