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Unraveling vibronic interactions in molecules functionalized with optical cycling centers
Pawel Wojcik, Haowen Zhou, Taras Khvorost +7
We report detailed characterization of the vibronic interactions between the first two electronically excited states, A and B, in SrOPh (Ph = phenyl, -C6H5) and its deuterated coun…
Vibronic coupling limits the use of high-lying electronic states in complex molecules for laser cooling
Haowen Zhou, Pawel Wojcik, Guo-Zhu Zhu +7
Laser cooling of large, complex molecules is a long-standing goal, instrumental for enabling new quantum technology and precision measurements. A primary consideration for the feas…
Parameterized Attenuated Exchange for Generalized TDHF@ Applications
Barry Y. Li, Tim Duong, Tucker Allen +3
Building upon our previously developed time-dependent Hartree-Fock (TDHF)@ method, based on many-body perturbation theory and specifically the Bethe-Salpeter Equation (BSE), w…