Unveiling Quantum Interference in the D<sup>+</sup> + H<sub>2</sub> Nonadiabatic Reaction Dynamics at Low Collision Energies

Mao, Ye; Yang, Zijiang; Buren, Bayaer; Chen, Maodu

doi:10.1021/acs.jpca.3c07097

J. Phys. Chem. A

2024

DOI: 10.1021/acs.jpca.3c07097

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Unveiling Quantum Interference in the D⁺ + H₂ Nonadiabatic Reaction Dynamics at Low Collision Energies

Ye Mao,

Zijiang Yang,

Bayaer Buren

et al.

Abstract: Fully converged nonadiabatic dynamics calculations of the D + + H 2 → H + + HD reaction are performed at low temperatures using the time-dependent wave packet approach based on a set of precise 3 × 3 diabatic potential energy surfaces (PESs) (Phys.

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Unveiling Quantum Interference in the D⁺ + H₂ Nonadiabatic Reaction Dynamics at Low Collision Energies

Abstract: Fully converged nonadiabatic dynamics calculations of the D + + H 2 → H + + HD reaction are performed at low temperatures using the time-dependent wave packet approach based on a set of precise 3 × 3 diabatic potential energy surfaces (PESs) (Phys.

Cited by 0 publications

References 65 publications

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Unveiling Quantum Interference in the D+ + H2 Nonadiabatic Reaction Dynamics at Low Collision Energies

Abstract: Fully converged nonadiabatic dynamics calculations of the D + + H 2 → H + + HD reaction are performed at low temperatures using the time-dependent wave packet approach based on a set of precise 3 × 3 diabatic potential energy surfaces (PESs) (Phys.

Cited by 0 publications

References 65 publications

No citations

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Unveiling Quantum Interference in the D⁺ + H₂ Nonadiabatic Reaction Dynamics at Low Collision Energies