Yuezhi Mao

3.7k total citations · 1 hit paper
51 papers, 1.7k citations indexed

About

Yuezhi Mao is a scholar working on Atomic and Molecular Physics, and Optics, Physical and Theoretical Chemistry and Materials Chemistry. According to data from OpenAlex, Yuezhi Mao has authored 51 papers receiving a total of 1.7k indexed citations (citations by other indexed papers that have themselves been cited), including 37 papers in Atomic and Molecular Physics, and Optics, 21 papers in Physical and Theoretical Chemistry and 17 papers in Materials Chemistry. Recurrent topics in Yuezhi Mao's work include Advanced Chemical Physics Studies (23 papers), Spectroscopy and Quantum Chemical Studies (15 papers) and Photochemistry and Electron Transfer Studies (14 papers). Yuezhi Mao is often cited by papers focused on Advanced Chemical Physics Studies (23 papers), Spectroscopy and Quantum Chemical Studies (15 papers) and Photochemistry and Electron Transfer Studies (14 papers). Yuezhi Mao collaborates with scholars based in United States, China and United Kingdom. Yuezhi Mao's co-authors include Martin Head‐Gordon, Paul R. Horn, Yihan Shao, Teresa Head‐Gordon, Omar Demerdash, Qinghui Ge, Matthias Loipersberger, Daniel S. Levine, Thomas E. Markland and Zheng Pei and has published in prestigious journals such as Journal of the American Chemical Society, The Journal of Chemical Physics and The Journal of Physical Chemistry B.

In The Last Decade

Yuezhi Mao

48 papers receiving 1.7k citations

Hit Papers

align trajectories

What are hit papers?

Hit papers significantly outperform the citation benchmark for their cohort. A paper qualifies if it has ≥500 total citations, achieves ≥1.5× the top-1% citation threshold for papers in the same subfield and year (this is the minimum needed to enter the top 1%, not the average within it), or reaches the top citation threshold in at least one of its specific research topics.

SPICE, A Dataset of Drug-like Molecules and Peptides for Training Machine Learning Potentials

2023 104 citations Yuezhi Mao, Thomas E. Markland et al. profile →

Peers

Countries citing papers authored by Yuezhi Mao

Since Specialization

Citations

This map shows the geographic impact of Yuezhi Mao's research. It shows the number of citations coming from papers published by authors working in each country. You can also color the map by specialization and compare the number of citations received by Yuezhi Mao with the expected number of citations based on a country's size and research output (numbers larger than one mean the country cites Yuezhi Mao more than expected).

Fields of papers citing papers by Yuezhi Mao

Since Specialization

Physical SciencesHealth SciencesLife SciencesSocial Sciences

This network shows the impact of papers produced by Yuezhi Mao. Nodes represent research fields, and links connect fields that are likely to share authors. Colored nodes show fields that tend to cite the papers produced by Yuezhi Mao. The network helps show where Yuezhi Mao may publish in the future.

Co-authorship network of co-authors of Yuezhi Mao

This figure shows the co-authorship network connecting the top 25 collaborators of Yuezhi Mao. A scholar is included among the top collaborators of Yuezhi Mao based on the total number of citations received by their joint publications. Widths of edges represent the number of papers authors have co-authored together. Node borders signify the number of papers an author published with Yuezhi Mao. Yuezhi Mao is excluded from the visualization to improve readability, since they are connected to all nodes in the network.

All Works

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20 of 20 papers shown

#	Work	Indexed citations
1	Toward an Understanding of Linear Scaling Relations through Energy Decomposition Analysis 2025 ·JACS Au ·(unknown), (unknown), Zheng Pei, (unknown), (unknown), Yu Zhang, G. T. Kasun Kalhara Gunasooriya, Bin Wang, Yuezhi Mao, Yihan Shao	0
2	On the entanglement of chromophore and solvent orbitals 2025 ·The Journal of Chemical Physics ·(unknown), Zheng Pei, (unknown), Junjie Yang, Xiaoliang Pan, Binju Wang, Yuezhi Mao, Yihan Shao	1
3	Beyond the Vibrational Stark Effect: Unraveling the Large Redshifts of Alkyne C–H Bond in Solvation Environments 2025 ·Journal of the American Chemical Society ·Chu Zheng, Yuezhi Mao, Thomas E. Markland, Steven G. Boxer	4
4	Environmentally Driven Symmetry Breaking Quenches Dual Fluorescence in Proflavine 2024 ·The Journal of Physical Chemistry Letters ·(unknown), Yuezhi Mao, Alex W. Chin, Tim J. Zuehlsdorff	7
5	Training machine learning potentials for reactive systems: A Colab tutorial on basic models 2023 ·Journal of Computational Chemistry ·Xiaoliang Pan, (unknown), (unknown), (unknown), (unknown), Richard Van, (unknown), (unknown), Yuezhi Mao, Ye Mei, Jingzhi Pu, Yihan Shao	4
6	Elucidating the Role of Hydrogen Bonding in the Optical Spectroscopy of the Solvated Green Fluorescent Protein Chromophore: Using Machine Learning to Establish the Importance of High-Level Electronic Structure 2023 ·The Journal of Physical Chemistry Letters ·Michael S. Chen, Yuezhi Mao, (unknown), (unknown), Andrés Montoya−Castillo, Tim J. Zuehlsdorff, Christine M. Isborn, Thomas E. Markland	14
7	Free Energy Profile Decomposition Analysis for QM/MM Simulations of Enzymatic Reactions 2023 ·Journal of Chemical Theory and Computation ·Xiaoliang Pan, Richard Van, Jingzhi Pu, Kwangho Nam, Yuezhi Mao, Yihan Shao	7
8	Machine learning based implicit solvent model for aqueous-solution alanine dipeptide molecular dynamics simulations 2023 ·RSC Advances ·(unknown), Richard Van, Xiaoliang Pan, Ji Hwan Park, Yuezhi Mao, Jingzhi Pu, Ye Mei, Yihan Shao	23
9	Force Decomposition Analysis: A Method to Decompose Intermolecular Forces into Physically Relevant Component Contributions 2023 ·The Journal of Physical Chemistry A ·Abdulrahman Aldossary, Martí Gimferrer, Yuezhi Mao, Hongxia Hao, Akshaya Kumar Das, Pedro Salvador, Teresa Head‐Gordon, Martin Head‐Gordon	7
10	Analytic high-order energy derivatives for metal nanoparticle-mediated infrared and Raman scattering spectra within the framework of quantum mechanics/molecular mechanics model with induced charges and dipoles 2022 ·The Journal of Chemical Physics ·Zheng Pei, Yuezhi Mao, Yihan Shao, WanZhen Liang	8
11	Cavity quantum-electrodynamical time-dependent density functional theory within Gaussian atomic basis. II. Analytic energy gradient 2022 ·The Journal of Chemical Physics ·Junjie Yang, Zheng Pei, (unknown), (unknown), Binbin Weng, Yuezhi Mao, Qi Ou, Yihan Shao	21
12	Solvent Organization and Electrostatics Tuned by Solute Electronic Structure: Amide versus Non-Amide Carbonyls 2022 ·The Journal of Physical Chemistry B ·Steven D.E. Fried, Chu Zheng, Yuezhi Mao, Thomas E. Markland, Steven G. Boxer	9
13	Computational investigation of substituent effects on the fluorescence wavelengths of oxyluciferin analogs 2022 ·Journal of Photochemistry and Photobiology A Chemistry ·(unknown), Enrico Benassi, Yuezhi Mao, Xiaoliang Pan, Chongzhao Ran, Xiaoyuan Chen, Yihan Shao	2
14	Elucidating the Electronic Structure of a Delayed Fluorescence Emitter via Orbital Interactions, Excitation Energy Components, Charge-Transfer Numbers, and Vibrational Reorganization Energies 2021 ·The Journal of Physical Chemistry Letters ·Zheng Pei, Qi Ou, Yuezhi Mao, Junjie Yang, Aurélien de la Lande, Felix Plasser, WanZhen Liang, Zhigang Shuai, Yihan Shao	50
15	Consistent inclusion of continuum solvation in energy decomposition analysis: theory and application to molecular CO ₂ reduction catalysts 2020 ·Chemical Science ·Yuezhi Mao, Matthias Loipersberger, (unknown), Jeffrey S. Derrick, Christopher J. Chang, Shaama Mallikarjun Sharada, Martin Head‐Gordon	51
16	Analysis and visualization of energy densities. II. Insights from linear-response time-dependent density functional theory calculations 2020 ·Physical Chemistry Chemical Physics ·Zheng Pei, Junjie Yang, (unknown), Yuezhi Mao, Qin Wu, Zhibo Yang, Bin Wang, Christine M. Aikens, WanZhen Liang, Yihan Shao	12
17	Analysis and visualization of energy densities. I. Insights from real-time time-dependent density functional theory simulations 2020 ·Physical Chemistry Chemical Physics ·Junjie Yang, Zheng Pei, (unknown), Yuezhi Mao, Qin Wu, Zhibo Yang, Bin Wang, Christine M. Aikens, WanZhen Liang, Yihan Shao	13
18	Constructing spin‐adiabatic states for the modeling of spin‐crossing reactions. I. A shared‐orbital implementation 2019 ·International Journal of Quantum Chemistry ·Peng Tao, Zheng Pei, Nicole Bellonzi, Yuezhi Mao, (unknown), WanZhen Liang, Zhibo Yang, Yihan Shao	4
19	Unraveling substituent effects on frontier orbitals of conjugated molecules using an absolutely localized molecular orbital based analysis 2018 ·Chemical Science ·Yuezhi Mao, Martin Head‐Gordon, Yihan Shao	60
20	Performance of the AMOEBA Water Model in the Vicinity of QM Solutes: A Diagnosis Using Energy Decomposition Analysis 2017 ·Journal of Chemical Theory and Computation ·Yuezhi Mao, Yihan Shao, Jacek Dziedzic, Chris‐Kriton Skylaris, Teresa Head‐Gordon, Martin Head‐Gordon	31

Rankless uses publication and citation data sourced from OpenAlex, an open and comprehensive bibliographic database. While OpenAlex provides broad and valuable coverage of the global research landscape, it—like all bibliographic datasets—has inherent limitations. These include incomplete records, variations in author disambiguation, differences in journal indexing, and delays in data updates. As a result, some metrics and network relationships displayed in Rankless may not fully capture the entirety of a scholar's output or impact.

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