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Xiang Sun

New York University · US
Area of research
Atomic and Molecular Physics, and Optics · Electrical and Electronic Engineering
Research interest
Research focused on Semiclassical physics and Charge (physics), with related work in Anharmonicity, Acceptor, Hamiltonian (control theory). Notable publications include 'Thermochromic aggregation-induced dual phosphorescence via temperature-dependent sp3-linked donor-acceptor electronic coupling', 'Charge transfer rate constants for the carotenoid-porphyrin-C60 molecular triad dissolved in tetrahydrofuran: The spin-boson model vs the linearized semiclassical approximation', and 'All-Atom Nonadiabatic Semiclassical Mapping Dynamics for Photoinduced Charge Transfer of Organic Photovoltaic Molecules in Explicit Solvents'.
h-index
citations
397
works
12
NIH funding
primary concept
email

Recent publications

Benchmarking various nonadiabatic semiclassical mapping dynamics methods with tensor-train thermo-field dynamics
The Journal of Chemical Physics 2024cited by 18position: lastdoi
How Sophisticated Are Neural Networks Needed to Predict Long-Term Nonadiabatic Dynamics?
Journal of Chemical Theory and Computation 2024cited by 13position: lastdoi
All-Atom Nonadiabatic Semiclassical Mapping Dynamics for Photoinduced Charge Transfer of Organic Photovoltaic Molecules in Explicit Solvents
Journal of Chemical Theory and Computation 2022cited by 26position: lastdoi
Effects of Heterogeneous Protein Environment on Excitation Energy Transfer Dynamics in the Fenna–Matthews–Olson Complex
The Journal of Physical Chemistry B 2022cited by 14position: lastdoi
Thermochromic aggregation-induced dual phosphorescence via temperature-dependent sp3-linked donor-acceptor electronic coupling
Nature Communications 2021cited by 149position: middledoi
Multi-state harmonic models with globally shared bath for nonadiabatic dynamics in the condensed phase
The Journal of Chemical Physics 2021cited by 26position: lastdoi
Three-state harmonic models for photoinduced charge transfer
The Journal of Chemical Physics 2021cited by 23position: lastdoi
Charge-Transfer Landscape Manifesting the Structure–Rate Relationship in the Condensed Phase <i>Via</i> Machine Learning
The Journal of Physical Chemistry B 2021cited by 21position: lastdoi
Linear-Response and Nonlinear-Response Formulations of the Instantaneous Marcus Theory for Nonequilibrium Photoinduced Charge Transfer
Journal of Chemical Theory and Computation 2021cited by 19position: lastdoi
Charge transfer rate constants for the carotenoid-porphyrin-C60 molecular triad dissolved in tetrahydrofuran: The spin-boson model vs the linearized semiclassical approximation
The Journal of Chemical Physics 2020cited by 45position: lastdoi
Photoinduced Charge Transfer Dynamics in the Carotenoid–Porphyrin–C <sub>60</sub> Triad via the Linearized Semiclassical Nonequilibrium Fermi’s Golden Rule
The Journal of Physical Chemistry B 2020cited by 24position: lastdoi
Molecular-Level Exploration of the Structure-Function Relations Underlying Interfacial Charge Transfer in the Subphthalocyanine/<mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" display="inline" overflow="scroll"><mml:msub><mml:mi mathvariant="normal">C</mml:mi><mml:mn>60</mml:mn></mml:msub></mml:math> Organic Photovoltaic System
Physical Review Applied 2020cited by 19position: middledoi

Grants

No grants ingested yet.

Frequent collaborators

Zhubin Hu · University of Houston6 papers (2020–2024)Barry D. Dunietz · Kent State University4 papers (2020–2021)Eitan Geva · University of Michigan–Ann Arbor4 papers (2020–2021)Dominikus Brian · New York University4 papers (2021–2021)Zengkui Liu · New York University3 papers (2021–2024)Margaret S. Cheung · Pacific Northwest National Laboratory3 papers (2020–2020) · 2 papers (2024–2024)Zhengqing Tong · University of Houston2 papers (2020–2020)Víctor S. Batista · Yale University1 papers (2024–2024)Guoqing Zhang · University of Virginia1 papers (2021–2021)Tao Wang · National University of Singapore1 papers (2021–2021)Hui Miao · Dalian Medical University1 papers (2021–2021)Buddhadev Maiti · Case Western Reserve University1 papers (2020–2020) · 1 papers (2024–2024) · 1 papers (2021–2021) · 1 papers (2024–2024)Xing Gao · University of Michigan–Ann Arbor1 papers (2020–2020)Srijana Bhandari · Case Western Reserve University1 papers (2020–2020)Pengzhi Zhang · Zhejiang University of Technology1 papers (2020–2020) · 1 papers (2020–2020)