Binbin Xie
0000-0002-5347-2795
5 papers found
Refreshing results…
Mechanistic Photophysics of Tellurium-Substituted Uracils: Insights from Multistate Complete-Active-Space Second-Order Perturbation Calculations
Photoinduced Curtius rearrangements of fluorocarbonyl azide, FC(O)N3: a QM/MM nonadiabatic dynamics simulation
QM/MM nonadiabatic dynamics simulations on photoinduced Wolff rearrangements of 1,2,3-thiadiazole
Short-time dynamics and decay mechanism of 2(1H)-pyridinone upon excitation to the light-absorbing S4(21𝝅𝝅*) state
Ab initio implementation of quantum trajectory mean-field approach and dynamical simulation of the N2CO photodissociation
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