ChiYung Yam

University of Electronic Science and Technology of China — China

Physics and Astronomy · Physical Sciences

29h-index2.9kcitations127works1.72yr avg
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Research Topics

Quantum and electron transport phenomena(27), Molecular Junctions and Nanostructures(22), Graphene research and applications(20), Advancements in Semiconductor Devices and Circuit Design(15), Spectroscopy and Quantum Chemical Studies(15)

Publications127 total

Revealing structure–property relationships and charge transfer dynamics in host–guest phosphorescent organic light-emitting diodes
The Journal of Chemical Physics·2025
A foundation machine learning potential with polarizable long-range interactions for materials modelling
Nature Communications·2025· 2 citedOpen Access
Machine-learning-enhanced density functional theory calculations
The Journal of Chemical Physics·2025· 1 cited
Enhancing Accuracy and Feature Insights in Hydration Free Energy Predictions for Small Molecules with Machine Learning
ACS Omega·2025Open Access
An epimer of threose nucleic acid enhances oligonucleotide exonuclease resistance through end capping
Communications Chemistry·2025· 2 citedOpen Access
A general protocol for phosphorescent platinum(II) complexes: generation, high throughput virtual screening and highly accurate predictions
Materials Futures·2025· 2 citedOpen Access
Theoretical Investigation of Polarization-Sensitive Photoresponse in the Donor–Acceptor Interface of Organic Photovoltaic Devices
The Journal of Physical Chemistry C·2025· 1 cited
Enhancing Accuracy and Feature Insights in Hydration Free Energy Predictions for Small Molecules with Machine Learning
arXiv (Cornell University)·2024Open Access
A foundation machine learning potential with polarizable long-range interactions for materials modelling
arXiv (Cornell University)·2024· 2 citedOpen Access
Enhancement of laser pulse induced photocurrents by topological states in graphene nanoribbons
Physical review. B./Physical review. B·2024· 3 cited
Designing thermally activated delayed fluorescence emitters with through-space charge transfer: a theoretical study
Physical Chemistry Chemical Physics·2024· 6 cited
Predictions of photophysical properties of phosphorescent platinum(<scp>II</scp>) complexes based on ensemble machine learning approach
Journal of Computational Chemistry·2023· 16 citedOpen Access
Glass-like Transport Dominates Ultralow Lattice Thermal Conductivity in Modular Crystalline Bi<sub>4</sub>O<sub>4</sub>SeCl<sub>2</sub>
Nano Letters·2023· 51 cited
Current Transients in Graphene Electronics under Single‐Particle Irradiation
Small Science·2023· 5 citedOpen Access
Carrier Relaxation and Multiplication in Bi Doped Graphene (Small 18/2023)
Small·2023Open Access
Self-Consistent-Charge Density-Functional Tight-Binding Parameters for Modeling an All-Solid-State Lithium Battery
Journal of Chemical Theory and Computation·2023· 11 cited
Predicting the Lattice Thermal Conductivity in Nitride Perovskite LaWN<sub>3</sub> from ab initio Lattice Dynamics
Advanced Science·2023· 42 citedOpen Access
Carrier Relaxation and Multiplication in Bi Doped Graphene
Small·2023· 2 cited
Predictions of photophysical properties of phosphorescent platinum(II) complexes based on ensemble machine learning approach
arXiv (Cornell University)·2023Open Access
Data-driven pursuit of electrochemically stable 2D materials with basal plane activity toward oxygen electrocatalysis
Energy & Environmental Science·2023· 61 cited
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Frequent Co-authors

GuanHua Chen(16), Thomas Frauenheim(14), Xiao Zheng(8), Lingyi Meng(8), Yu Zhang(6), Zhen Tong(6), Alessandro Pecchia(6), Traian Dumitrică(6), SiuKong Koo(5), Woon‐Ming Lau(3), Binghai Yan(3), Heng Tian(3), YiJing Yan(3), Shizheng Wen(3), Fuzhen Bi(3), Bing Huang(3), Ngai Wong(3), Chuan‐Jia Tong(2), Wei Geng(2), Zhen‐Kun Tang(2)