Yuzhe Zhang

7PUBLICATIONS
9CO-AUTHORS
Radiation and matterTheoretical quantum chemistryNonlinear optics and spectroscopyQuantum information, computation and communicationAtomic and molecular physics
Featured researcher

Get your video featured.

JoVEPublish with JoVE
Journal

Publications (7)

|Jul 27, 2026
Assessing Constrained Nuclear-Electronic Orbital Theory for the Floppy CH5+ Ion: Geometry-Dependent Zero-Point Effects on Structure, Hydrogen Rearrangement Dynamics, and Simulated IR Spectra.

|Dec 29, 2025
Analytic polarizability and vibrational Raman spectra from constrained nuclear-electronic orbital density functional theory.

Haoran Chen, Yuzhe Zhang, Yiwen Wang

|Oct 18, 2025
Characterizing Infrared Spectra of OH-·(H2O)2 and OH-·(H2O)3 with Constrained Nuclear-Electronic Orbital Molecular Dynamics.

Zhe Liu, Yiwen Wang, Yuzhe Zhang

|Dec 23, 2024
Assessment of electron-proton correlation functionals for vibrational spectra of shared-proton systems by constrained nuclear-electronic orbital density functional theory.

Yuzhuo Yang, Yuzhe Zhang, Yang Yang

|Oct 01, 2024
Where is the hidden intramolecular H-bonding vibrational signal in the proline matrix IR spectrum?

James Langford, Yuzhe Zhang, Zehua Chen

|Dec 14, 2023
Vibrational Spectra of Highly Anharmonic Water Clusters: Molecular Dynamics and Harmonic Analysis Revisited with Constrained Nuclear-Electronic Orbital Methods.

Yuzhe Zhang, Yiwen Wang, Xi Xu

Pageof 2

Frequent Collaborators

7 joint publications

Yang Yang

5 joint publications

Zehua Chen

4 joint publications

Yiwen Wang

3 joint publications

Xi Xu