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Updated: Feb 24, 2026

Coulomb Explosion Imaging as a Tool to Distinguish Between Stereoisomers
Published on: August 18, 2017
Radial Coupling at Conical Intersection Governs Competing Fragmentation Pathways in Halomethane Cations
Yupeng Liu1, Cong-Cong Jia2, Peipei Ge1
1Huazhong University of Science and Technology, Wuhan National Laboratory for Optoelectronics and School of Physics, Wuhan 430074, China.
Researchers achieved selective bond cleavage in halomethane cations using laser fields. They found that controlling radial coupling strength at conical intersections dictates whether C-Cl or C-H bonds break, enabling laser-driven reaction control.
Area of Science:
- Photochemistry
- Chemical Physics
- Molecular Dynamics
Background:
- Selective bond cleavage in polyatomic molecules is challenging due to nonadiabatic dynamics.
- Conical intersections play a critical role in molecular fragmentation pathways.
Purpose of the Study:
- To investigate the control of bond selectivity in halomethane cations under strong laser fields.
- To elucidate the role of nonadiabatic couplings in directing molecular fragmentation.
Main Methods:
- Time-resolved Coulomb explosion imaging.
- Quantum wave packet simulations.
- Theoretical modeling of nonadiabatic dynamics.
Main Results:
- Observed a reversal in bond selectivity between CH3Cl+ (C-Cl cleavage) and CH3F+ (C-H fission).
- Attributed selectivity to halogen-dependent radial coupling strength at conical intersections.
- Demonstrated how coupling strength influences wave packet dynamics and fragmentation pathways.
Conclusions:
- Radial coupling strength at conical intersections is a key control parameter for multibond fragmentation.
- Laser-driven control of nonadiabatic couplings offers new pathways for selective chemical reactions.
- Findings provide insights into controlling molecular dissociation dynamics.
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