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Li-Juan Yu · SciRah

Researcher profile · Semantic Scholar

Li-Juan Yu

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Li-Juan Yu — researcher profile on SciRah

h-index: 24
Works: 66
Citations: 1,809

Most-cited papers

Bioinspired graphene membrane with temperature tunable channels for water gating and molecular separation
Jing-Chong Liu, Nü Wang, Li-Juan Yu, A. Karton +8 more
2017Nature Communications214 citations Open access
Semantic Scholar
The corona of a surface bubble promotes electrochemical reactions
Y. B. Vogel, Cameron W. Evans, M. Belotti, Long-Kun Xu +9 more
2020Nature Communications137 citations Open access
Semantic Scholar
High-Performance Janus Solar Evaporator for Water Purification with Broad Spectrum Absorption and Ultralow Heat Loss
Lanlan Hou, Nü Wang, Li-Juan Yu, Jing-Chong Liu +7 more
2022ACS Energy Letters114 citations
Semantic Scholar
MoS2 Hollow Multishelled Nanospheres Doped Fe Single Atoms Capable of Fast Phase Transformation for Fast-charging Na-ion Batteries.
Hui Zhang, Shaocheng Zhang, Baiyu Guo, Li-Juan Yu +8 more
2024Angewandte Chemie104 citations
Semantic Scholar
Proton enhanced dynamic battery chemistry for aprotic lithium–oxygen batteries
Yun-Guang Zhu, Qi Liu, Yang-Chun Rong, Hao-Min Chen +8 more
2017Nature Communications102 citations Open access
Semantic Scholar
Construction of Ti4O7/TiN/carbon Microdisk Sulfur Host with Strong Polar N–Ti–O Bond for Ultralong Life Lithium–Sulfur Battery
Lin-Lin Ma, Li-Juan Yu, Jing-Chong Liu, Ya-Qiong Su +10 more
2021Energy Storage Materials99 citations
Semantic Scholar
Thermoresponsive Graphene Membranes with Reversible Gating Regularity for Smart Fluid Control
Jing-Chong Liu, Li-Juan Yu, G. Yue, Nü Wang +8 more
2019Advanced Functional Materials88 citations
Semantic Scholar
Reaction barrier heights for cycloreversion of heterocyclic rings: An Achilles’ heel for DFT and standard ab initio procedures
Li-Juan Yu, Farzaneh Sarrami, Robert J. O’Reilly, A. Karton
201578 citations Open access
Semantic Scholar
Assessment of theoretical procedures for a diverse set of isomerization reactions involving double-bond migration in conjugated dienes
Li-Juan Yu, A. Karton
201465 citations Open access
Semantic Scholar
CO intermediate-assisted dynamic Cu sintering during electrocatalytic CO2 reduction on Cu‒N‒C catalysts.
Yan-Yang Qin, Wen-Shan Zhao, Chen Xia, Li-Juan Yu +7 more
2024Angewandte Chemie57 citations Open access
Semantic Scholar
Understanding Cement Hydration of Cemented Paste Backfill: DFT Study of Water Adsorption on Tricalcium Silicate (111) Surface
Chongchong Qi, Lang Liu, Jian-Yong He, Qiusong Chen +2 more
2019Minerals55 citations Open access
Semantic Scholar
Reversible Transformation and Distribution Determination of Diverse Pt Single-Atom Species.
Chuanmin Ding, Qing-Qing Gu, Li-Juan Yu, Shaocheng Zhang +10 more
2023Journal of the American Chemical Society52 citations
Semantic Scholar
Ribulose 1,5-bisphosphate carboxylase/oxygenase activates O2 by electron transfer
Camille Bathellier, Li-Juan Yu, G. Farquhar, M. Coote +2 more
2020Proceedings of the National Academy of Sciences of the United States of America49 citations Open access
Semantic Scholar
Heats of formation of the amino acids re-examined by means of W1-F12 and W2-F12 theories
A. Karton, Li-Juan Yu, M. Kesharwani, Jan M. L. Martin
2014Theoretical Chemistry accounts39 citations Open access
Semantic Scholar
Lewis Acid-Induced Reversible Disproportionation of TEMPO Enables Aqueous Aluminum Radical Batteries.
Shangxu Jiang, Yi-Hui Xie, Yuan Xie, Li-Juan Yu +6 more
2023Journal of the American Chemical Society37 citations
Semantic Scholar
Extending the shell-isolated nanoparticle-enhanced Raman spectroscopy approach to interfacial ionic liquids at single crystal electrode surfaces.
Meng Zhang, Li-Juan Yu, Yi-Fan Huang, Jiawei Yan +4 more
2014Chemical Communications32 citations
Semantic Scholar
Electrostatic Switching between SN1 and SN2 Pathways.
Li-Juan Yu, M. Coote
2019Journal of Physical Chemistry A31 citations Open access
Semantic Scholar
Recycle Waste Washcloth to Design Fe3o4/Fes2/C Heterojunction Membrane as High-Area Capacity Freestanding Anode for Sodium-Ion Batteries
Qing Lin, Shaocheng Zhang, Li-Juan Yu, Baoxiu Hou +4 more
2022Social Science Research Network29 citations Open access
Semantic Scholar
Can DFT and ab initio methods describe all aspects of the potential energy surface of cycloreversion reactions?
Li-Juan Yu, Farzaneh Sarrami, Robert J. O’Reilly, A. Karton
201628 citations Open access
Semantic Scholar
Okra-Like Multichannel TiO@NC Fibers Membrane with Spatial and Chemical Restriction on Shuttle-Effect for Lithium–Sulfur Batteries
Shuai Li, Jing-Chong Liu, Lin-Lin Ma, Li-Juan Yu +8 more
2022Advanced Fiber Materials27 citations
Semantic Scholar
pH-responsive laminar WSe2 membrane with photocatalytic antifouling property for ultrafast water transport
Feng-Shun Zhang, Li-Juan Yu, Jing-Chong Liu, Lanlan Hou +9 more
2022Chemical Engineering Journal26 citations
Semantic Scholar
Binding interaction and raman spectra of p-π conjugated molecules containing CH2/NH2 groups adsorbed on silver surfaces: A DFT study of wagging modes
S. Tao, Li-Juan Yu, R. Pang, Yi-Fan Huang +2 more
201326 citations
Semantic Scholar
An assessment of theoretical procedures for π-conjugation stabilisation energies in enones
Li-Juan Yu, Farzaneh Sarrami, A. Karton, Robert J. O’Reilly
201525 citations
Semantic Scholar
Atomic Dispersion of Pt Clusters Encapsulated Within ZSM‐5 Depending on Aluminum Sites and Calcination Temperature
Shaocheng Zhang, Yufeng Li, Chuanmin Ding, Y. Niu +6 more
2022Small Structures24 citations Open access
Semantic Scholar
Solvent effect and hydrogen bond interaction on tautomerism, vibrational frequencies, and Raman spectra of guanine: a density functional theoretical study.
Li-Juan Yu, R. Pang, S. Tao, Hong-Tao Yang +2 more
2013Journal of Physical Chemistry A21 citations
Semantic Scholar
Exploiting Chitin as a Source of Biologically Fixed Nitrogen: Formation and Full Characterization of Small Molecule Hetero- and Carbo-Cyclic Pyrolysis Products.
Maryam Nikahd, Jiří Mikušek, Li-Juan Yu, M. Coote +3 more
2020Journal of Organic Chemistry18 citations Open access
Semantic Scholar
Computational insights for the hydride transfer and distinctive roles of key residues in cholesterol oxidase
Li-Juan Yu, E. Golden, N. Chen, Yuan Zhao +2 more
2017Scientific Reports17 citations Open access
Semantic Scholar
DFT Study of Hydrogen-Bonding Interaction, Solvation Effect, and Electric-Field Effect on Raman Spectra of Hydrated Proton.
R. Pang, Li-Juan Yu, Meng Zhang, Z. Tian +1 more
2016Journal of Physical Chemistry A15 citations Open access
Semantic Scholar
Polymerization of Vinyl Chloride at Ambient Temperature Using Macromolecular Design via the Interchange of Xanthate: Kinetic and Computational Studies
Carlos M. R. Abreu, Talita C. Rezende, A. Fonseca, T. Guliashvili +6 more
2020Macromolecules14 citations Open access
Semantic Scholar
An extended N-H bond, driven by a conserved second-order interaction, orients the flavin N5 orbital in cholesterol oxidase
E. Golden, Li-Juan Yu, F. Meilleur, M. Blakeley +3 more
2017Scientific Reports13 citations Open access
Semantic Scholar
Mechanistic Insights into Water-Catalyzed Formation of Levoglucosenone from Anhydrosugar Intermediates by Means of High-Level Theoretical Procedures
W. Wan, Li-Juan Yu, A. Karton
201613 citations Open access
Semantic Scholar
Photoactive Metal Carbonyl Complexes Bearing N-Heterocyclic Carbene Ligands: Synthesis, Characterization, and Viability as Photoredox Catalysts.
Mei-Qiong Tang, L. Cameron, Eve M. Poland, Li-Juan Yu +9 more
2022Inorganic Chemistry12 citations Open access
Semantic Scholar
Benchmark study of DFT and composite methods for bond dissociation energies in argon compounds
Li-Juan Yu, Stephen G. Dale, Bun Chan, A. Karton
2020Chemistry Physics12 citations Open access
Semantic Scholar
Tuning Nanochannel Microenvironments of a Thermoresponsive MXene Membrane for Mixed Molecule Gradient Separation.
Jing-Chong Liu, Zhen Li, Li-Juan Yu, Yulu Huo +5 more
2024Nano letters (Print)11 citations
Semantic Scholar
Computational design of bio-inspired carnosine-based HOBr antioxidants
Farzaneh Sarrami, Li-Juan Yu, A. Karton
2017Journal of Computer-Aided Molecular Design11 citations
Semantic Scholar
Surface electron-hydronium ion-pair bound to silver and gold cathodes: A density functional theoretical study of photocatalytic hydrogen evolution reaction
R. Pang, Li-Juan Yu, De-Yin Wu, Bing-Wei Mao +1 more
201311 citations
Semantic Scholar
Re-Examination of Proline-Catalyzed Intermolecular Aldol Reactions: An Ab Initio Kinetic Modelling Study
Li-Juan Yu, Mitchell T. Blyth, M. Coote
2021Topics in catalysis9 citations Open access
Semantic Scholar
Bimetallic Nickel Complexes Supported by a Planar Macrocyclic Diphosphoranide Ligand.
Andie R Delaney, Li-Juan Yu, Vincent Doan, M. Coote +1 more
2022Chemistry7 citations Open access
Semantic Scholar
Electrostatic Switching of Stereoselectivity in Aldol Reactions.
Li-Juan Yu, M. Coote
2021Journal of Organic Chemistry7 citations Open access
Semantic Scholar
Evaluation of the performance of MP4-based procedures for a wide range of thermochemical and kinetic properties
Li-Juan Yu, W. Wan, A. Karton
20167 citations Open access
Semantic Scholar
Synergistic Optimization of WP/WS2 Electrocatalyst by P/S Dual Vacancies and Heterojunctions for Hydrogen Evolution and Zn-H2O Batteries.
Yaxin Tong, Zengxin Jiang, Li-Juan Yu, Yunyun Bai +7 more
2025Inorganic Chemistry6 citations
Semantic Scholar
Atom Transfer Radical Polymerization-Inspired Room Temperature (sp3)C-N Coupling.
Alfred K. K. Fung, Li-Juan Yu, M. Sherburn, M. Coote
2021Journal of Organic Chemistry6 citations Open access
Semantic Scholar
Sulphuric acid-catalysed formation of hemiacetal from glyoxal and ethanol
Farzaneh Sarrami, Li-Juan Yu, W. Wan, A. Karton
20176 citations
Semantic Scholar
To bridge or not to bridge: The role of sulfuric acid in the Beckmann rearrangement
Chester Lin, Li-Juan Yu, Shu-Hua Li, A. Karton
20166 citations Open access
Semantic Scholar
Thermochemistry of icosahedral closo-dicarboranes: A composite ab initio quantum-chemical perspective
Farzaneh Sarrami, Li-Juan Yu, A. Karton
20166 citations Open access
Semantic Scholar
What's in an atom? A comparison of carbon and silicon-centered amidinium···carboxylate frameworks.
Stephanie A. Boer, Li-Juan Yu, Tobias L. Genet, Kaycee Low +4 more
2020Chemistry5 citations Open access
Semantic Scholar
Tuning the electronic state of Ni/Mo of heterostructure electrocatalyst by interface engineering for water splitting
Mingsong Fan, Li-Juan Yu, Lin Gao, Li-Li Cui +1 more
2025International journal of hydrogen energy4 citations
Semantic Scholar
Gold Catalysed Site-Selective Cross-Coupling of Tertiary -Silylamines with 1-Iodoalkynes Under UVA LED Light
Yi-Chao Zhao, James Merrett, Jian-Wen Jin, Li-Juan Yu +2 more
2023Organic Chemistry Frontiers4 citations
Semantic Scholar
Computational Design of Next Generation At-om Transfer Radical Polymerization Ligands
Madeleine Stewart, Li-Juan Yu, M. Sherburn, M. Coote
2022Polymer Chemistry4 citations Open access
Semantic Scholar
Room Temperature Hydrolysis of Benzamidines and Benzamidiniums in Weakly Basic Water.
Li-Juan Yu, D. Cullen, Mahbod Morshedi, M. Coote +1 more
2021Journal of Organic Chemistry4 citations Open access
Semantic Scholar

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