Deping Hu

Affiliations: 
Tsinghua University 
Area:
Nonadiabatic dynamics, Machine learning, OLED
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"Deping Hu"
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Publications

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Huang H, Peng J, Lan Z, et al. (2025) Nonadiabatic Dynamics of Intersystem Crossings with the Symmetrical Quasi-Classical Dynamics Method Based on the Meyer-Miller Mapping Hamiltonian. Journal of Chemical Theory and Computation
Hu D, Chng BXK, Ying W, et al. (2025) Trajectory-based non-adiabatic simulations of the polariton relaxation dynamics. The Journal of Chemical Physics. 162
Zhang J, Peng J, Hu D, et al. (2025) What Two-Dimensional Electronic Spectroscopy Can Tell Us about Energy Transfer in Dendrimers: Ab Initio Simulations. The Journal of Physical Chemistry Letters. 16: 1007-1015
Peng J, Hu D, Liu H, et al. (2023) Studies of nonadiabatic dynamics in the singlet fission processes of pentacene dimer via tensor network method. The Journal of Chemical Physics. 159
Zhang J, Peng J, Zhu Y, et al. (2023) Influence of Mode-Specific Excitation on the Nonadiabatic Dynamics of Methyl Nitrate (CHONO). The Journal of Physical Chemistry Letters. 6542-6549
Hu D, Huo P. (2023) Ab Initio Molecular Cavity Quantum Electrodynamics Simulations Using Machine Learning Models. Journal of Chemical Theory and Computation
Hu D, Mandal A, Weight BM, et al. (2022) Quasi-diabatic propagation scheme for simulating polariton chemistry. The Journal of Chemical Physics. 157: 194109
Xu C, Lin K, Hu D, et al. (2022) Ultrafast Internal Conversion Dynamics through the on-the-Fly Simulation of Transient Absorption Pump-Probe Spectra with Different Electronic Structure Methods. The Journal of Physical Chemistry Letters. 13: 661-668
Hu D, Peng J, Chen L, et al. (2021) Spectral Fingerprint of Excited-State Energy Transfer in Dendrimers through Polarization-Sensitive Transient-Absorption Pump-Probe Signals: On-the-Fly Nonadiabatic Dynamics Simulations. The Journal of Physical Chemistry Letters. 9710-9719
Zhang J, Peng J, Hu D, et al. (2021) Investigation of nonadiabatic dynamics in the photolysis of methyl nitrate (CHONO) by on-the-fly surface hopping simulation. Physical Chemistry Chemical Physics : Pccp
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