Yang Liu

17PUBLICATIONS
25CO-AUTHORS
Main group metal chemistryTheoretical quantum chemistryCatalysis and mechanisms of reactionsChemical thermodynamics and energeticsRadiation and matter
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Publications (17)

|Jun 25, 2026
Dynamics of CO2 activation by gas-phase transition metal ions: the importance of intersystem crossing.

|May 04, 2026
Full-dimensional potential energy surface for the H2 + N2 system and quantum scattering calculations of collision-induced rotational energy transfer.

|Sep 29, 2025
Two-dimensional ring polymer molecular dynamics determination of the MnO+ + H2/D2 reaction rates on a Δ-machine learned potential energy surface.

Yang Liu, Chen Li, Milan Ončák

|Aug 11, 2025
CO2 activation by gaseous zirconium cations: competition between spin-changing and spin-conserving pathways.

Marcel Meta, Yang Liu, Martin Wedele

|Jul 08, 2025
Kinetics and Product Branching in Dihydrogen Activation by Gaseous Manganese Monoxide Cations.

Yang Liu, Milan Ončák, Hua Guo

|Feb 19, 2025
Insights into facile methane activation by a spin forbidden reaction with Ta+ ions in the gas phase.

Yang Liu, Milan Ončák, Tucker W R Lewis

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Frequent Collaborators

13 joint publications

Hua Guo

7 joint publications

Jun Li

6 joint publications

Milan Ončák

5 joint publications

Jennifer Meyer