Yan GroupNortheastern University

Publications

Full list with citation metrics on Google Scholar and ORCID. Preprints are listed under their arXiv year.

2026

  1. T.-W. Hsu, A. Bansil, Q. Yan, “Symmetry- and Property-Aware Crystal Generation with Reinforcement Learning for Inverse Materials Design,” arXiv:2609.13468 (2026). link
  2. A. J. Heilman, Q. Yan, “Point Group Equivariant Graph Neural Networks for Materials,” arXiv:2607.16871 (2026). link
  3. Z. Fang, Q. Yan, “A Multi-Scale Machine Learning Framework for Coupled Chemical, Spin, and Structural Disorder in Alloys,” arXiv:2607.07456 (2026). link
  4. A. Aryal, W. Gong, H. Banjade, Q. Yan, “Materials Representation Learning Based on a Material–Motif Network and Heterogeneous Graphs,” Advanced Intelligent Discovery, e70142 (2026). link
  5. Z. Fang, Q. Yan, “Towards the predictive design of quantum defects for next-generation quantum technologies,” Communications Materials 7, 155 (2026). link
  6. T.-W. Hsu, Z. Fang, A. Bansil, Q. Yan, “Accurate prediction of tensorial spectra using equivariant graph neural network,” Nature Communications 17, 3330 (2026). link
  7. Z. Fang, T.-W. Hsu, Q. Yan, “Learning atomic representations for data-driven materials design,” AI for Science 2, 013001 (2026). link

2025

  1. Y. Liu, A. Aryal, K. Yang, D. Calugaru, Z. Fang, H. Hu, Q. Yan, B. A. Bernevig, C.-x. Liu, “Ideal Topological Flat Bands in Two-dimensional Moiré Heterostructures with Type-II Band Alignment,” arXiv:2507.06168 (2025). link
  2. Q. Yan, T. Li, X. Gao, S. Vaidya, S. Dikshit, Y. Luo, S. Strauf, R. Moukaouine, A. Pershin, A. Gali, Z. Fang, H. Stanfield, I. J. Vera-Marun, M. Newburger, S. Singh, T. Zhu, M. Brotons-Gisbert, K. D. Jöns, B. D. Gerardot, B. S. Y. Kim, J. R. Schaibley, K. L. Seyler, J. Balgley, J. Hone, K. C. Fong, L. Wang, G. Burkard, Y. Zeng, T. Heindel, S. Ateş, T. Vogl, I. Aharonovich, “Roadmap: 2D Materials for Quantum Technologies,” arXiv:2512.14973 (2025). link
  3. A. J. Heilman, W. Gong, Q. Yan, “Crystal hypergraph convolutional networks,” npj Computational Materials 11, 336 (2025). link
  4. Z. Fang, T.-W. Hsu, Q. Yan, “A Machine Learning Framework for Modeling Ensemble Properties of Atomically Disordered Materials,” ACS Nano 19, 37353--37363 (2025). link
  5. S. Vaidya, X. Gao, S. Dikshit, Z. Fang, A. E. Llacsahuanga Allcca, Y. P. Chen, Q. Yan, T. Li, “Coherent Spins in van der Waals Semiconductor GeS2 at Ambient Conditions,” Nano Letters 25, 14356--14362 (2025). link
  6. L. Frammolino, M. Holbrook, C. Lei, J.-Y. Tsai, Y. Wan, L.-Y. Huang, L.-J. Li, Q. Yan, A. MacDonald, C.-K. Shih, “Microscopic Investigations of Point Defect Interactions in WS2 Monolayers,” ACS Nano 19, 33059--33069 (2025). link
  7. Z. Fang, T.-W. Hsu, Q. Yan, “Dataset of tensorial optical and transport properties of materials from the Wannier function method,” Scientific Data 12, 1092 (2025). link
  8. Y. Qi, W. Gong, Q. Yan, “Bridging deep learning force fields and electronic structures with a physics-informed approach,” npj Computational Materials 11, 177 (2025). link
  9. Q. Yan, J. L. Lyons, L. Gordon, A. Janotti, C. G. Van de Walle, “Oxygen impurities in AlN and their impact on optical absorption,” Applied Physics Letters 126, 062106 (2025). link
  10. Z. Fang, Q. Yan, “Leveraging Persistent Homology Features for Accurate Defect Formation Energy Predictions via Graph Neural Networks,” Chemistry of Materials 37, 1531--1540 (2025). link
  11. Z. Wang, T. Xie, Z. Fang, J. Zhang, C. Gong, Q. Yan, S. Ren, “Chiral Molecular Magnet Superstructures with Light Control,” Nano Letters 25, 2502--2508 (2025). link

2024

  1. W. Gong, T. Sun, H. Bai, J.-Y. Tsai, H. Ling, Q. Yan, “Graph Transformer Networks for Accurate Band Structure Prediction: An End-to-End Approach,” arXiv:2411.16483 (2024). link
  2. A. Heilman, C. Schlesinger, Q. Yan, “Equivariant Graph Neural Networks for Prediction of Tensor Material Properties of Crystals,” arXiv:2406.03563 (2024). link
  3. J.-Y. Tsai, W. Gong, Q. Yan, “Symmetry-guided data-driven discovery of native quantum defects in two-dimensional materials,” arXiv:2405.11379 (2024). link
  4. Z. Fang, Q. Yan, “Towards accurate prediction of configurational disorder properties in materials using graph neural networks,” npj Computational Materials 10, 91 (2024). link
  5. Z. Wang, Y. Huang, W. Gong, Q. Yan, S. Ren, “Lithiation bridged molecular conducting magnets,” Applied Materials Today 38, 102188 (2024). link
  6. Z. Wang, Q. Wang, W. Gong, A. Chen, A. Islam, L. Quan, T. J. Woehl, Q. Yan, S. Ren, “Magnet-in-ferroelectric crystals exhibiting photomultiferroicity,” Proceedings of the National Academy of Sciences 121, e2322361121 (2024). link
  7. G. Kim, B. Huet, C. E. Stevens, K. Jo, J.-Y. Tsai, S. Bachu, M. Leger, S. Song, M. Rahaman, K. Y. Ma, N. R. Glavin, H. S. Shin, N. Alem, Q. Yan, J. R. Hendrickson, J. M. Redwing, D. Jariwala, “Confinement of excited states in two-dimensional, in-plane, quantum heterostructures,” Nature Communications 15, 6361 (2024). link
  8. Q. Yan, S. Kar, S. Chowdhury, A. Bansil, “The Case for a Defect Genome Initiative,” Advanced Materials 36, 2303098 (2024). link
  9. Q. Gao, Q. Yan, Z. Hu, L. Chen, “Bilayer Kagome Borophene with Multiple van Hove Singularities,” Advanced Science 11, 2305059 (2024). link
  10. X. Zhang, M. E. Turiansky, L. Razinkovas, M. Maciaszek, P. Broqvist, Q. Yan, J. L. Lyons, C. E. Dreyer, D. Wickramaratne, Á. Gali, A. Pasquarello, C. G. Van de Walle, “First-principles calculations of defects and electron–phonon interactions: Seminal contributions of Audrius Alkauskas to the understanding of recombination processes,” Journal of Applied Physics 135, 150901 (2024). link

2023

  1. W. Gong, T. Sun, H. Bai, S. T. u. R. Chowdhury, P. Chu, A. Aryal, J. Yu, H. Ling, J. P. Perdew, Q. Yan, “Incorporation of density scaling constraint in density functional design via contrastive representation learning,” Digital Discovery 2, 1404--1413 (2023). link
  2. Y. Huang, A. K. Pathak, J.-Y. Tsai, C. Rumsey, M. Ivill, N. Kramer, Y. Hu, M. Trebbin, Q. Yan, S. Ren, “Pressure-controlled magnetism in 2D molecular layers,” Nature Communications 14, 3186 (2023). link
  3. S. Singh, W. Gong, C. E. Stevens, J. Hou, A. Singh, H. Zhang, S. B. Anantharaman, A. D. Mohite, J. R. Hendrickson, Q. Yan, D. Jariwala, “Valley-Polarized Interlayer Excitons in 2D Chalcogenide–Halide Perovskite–van der Waals Heterostructures,” ACS Nano 17, 7487--7497 (2023). link
  4. C. Becher, W. Gao, S. Kar, C. D. Marciniak, T. Monz, J. G. Bartholomew, P. Goldner, H. Loh, E. Marcellina, K. E. J. Goh, T. S. Koh, B. Weber, Z. Mu, J.-Y. Tsai, Q. Yan, T. Huber-Loyola, S. Höfling, S. Gyger, S. Steinhauer, V. Zwiller, “2023 roadmap for materials for quantum technologies,” Materials for Quantum Technology 3, 012501 (2023). link

2022

  1. H. Tang, S. Neupane, Q. Yan, A. Ruzsinszky, “Density Functional Theory Study of Controllable Optical Absorptions and Magneto-Optical Properties of Magnetic CrI3 Nanoribbons: Implications for Compact 2D Magnetic Devices,” ACS Applied Nano Materials 5, 14388--14399 (2022). link
  2. Y. Huang, W. Gong, G. Zhang, Z. Li, H. Lin, Q. Yan, S. Ren, “Dimensional Transformation of Molecular Magnetic Materials,” ACS Nano 16, 13232--13240 (2022). link
  3. J.-Y. Tsai, J. Pan, H. Lin, A. Bansil, Q. Yan, “Antisite defect qubits in monolayer transition metal dichalcogenides,” Nature Communications 13, 492 (2022). link
  4. Y. Hu, W. Gong, S. Wei, S. Khuje, Y. Huang, Z. Li, Y. C. Li, F. Yao, Q. Yan, S. Ren, “Lithiating magneto-ionics in a rechargeable battery,” Proceedings of the National Academy of Sciences 119, e2122866119 (2022). link
  5. A. Sheng, S. Khuje, J. Yu, T. Parker, J.-Y. Tsai, L. An, Y. Huang, Z. Li, C.-G. Zhuang, L. Kester, Q. Yan, S. Ren, “Copper Nanoplates for Printing Flexible High-Temperature Conductors,” ACS Applied Nano Materials 5, 4028--4037 (2022). link
  6. H. Bai, P. Chu, J.-Y. Tsai, N. Wilson, X. Qian, Q. Yan, H. Ling, “Graph neural network for Hamiltonian-based material property prediction,” Neural Computing and Applications 34, 4625--4632 (2022). link

2021

  1. M. H. Richter, E. A. Peterson, L. Zhou, A. A. Shinde, P. F. Newhouse, Q. Yan, S. W. Fackler, J. Yano, J. K. Cooper, K. A. Persson, J. B. Neaton, J. M. Gregoire, “Band Edge Energy Tuning through Electronic Character Hybridization in Ternary Metal Vanadates,” Chemistry of Materials 33, 7242--7253 (2021). link
  2. H. R. Banjade, S. Hauri, S. Zhang, F. Ricci, W. Gong, G. Hautier, S. Vucetic, Q. Yan, “Structure motif–centric learning framework for inorganic crystalline systems,” Science Advances 7, eabf1754 (2021). link
  3. W. Gong, Q. Yan, “Graph-based deep learning frameworks for molecules and solid-state materials,” Computational Materials Science 195, 110332 (2021). link
  4. Y.-F. Zhang, J. Pan, H. Banjade, J. Yu, H. Lin, A. Bansil, S. Du, Q. Yan, “Two-dimensional MX Dirac materials and quantum spin Hall insulators with tunable electronic and topological properties,” Nano Research 14, 584--589 (2021). link
  5. H. R. Banjade, J. Pan, Q. Yan, “Monolayer 2D semiconducting tellurides for high-mobility electronics,” Physical Review Materials 5, 014005 (2021). link
  6. N. H. Attanayake, H. R. Banjade, A. C. Thenuwara, B. Anasori, Q. Yan, D. R. Strongin, “Electrocatalytic CO2 reduction on earth abundant 2D Mo2C and Ti3C2 MXenes,” Chemical Communications 57, 1675--1678 (2021). link

2020

  1. F. Hu, S. C. Abeyweera, J. Yu, D. Zhang, Y. Wang, Q. Yan, Y. Sun, “Quantifying Electrocatalytic Reduction of CO2 on Twin Boundaries,” Chem 6, 3007--3021 (2020). link
  2. L. Zhang, J. Pan, Q. Yan, Z. Hu, “Computational Study of a Novel 2D Ferromagnetic Metal: the Ce2C Monolayer,” physica status solidi (RRL) – Rapid Research Letters 14, 2000324 (2020). link
  3. J. Pan, Y.-F. Zhang, J. Zhang, H. Banjade, J. Yu, L. Yu, S. Du, A. Ruzsinszky, Z. Hu, Q. Yan, “Auxetic two-dimensional transition metal selenides and halides,” npj Computational Materials 6, 154 (2020). link
  4. J. Pan, J. Yu, Y.-F. Zhang, S. Du, A. Janotti, C.-X. Liu, Q. Yan, “Quantum anomalous Hall effect in two-dimensional magnetic insulator heterojunctions,” npj Computational Materials 6, 152 (2020). link
  5. S. C. Abeyweera, J. Yu, J. P. Perdew, Q. Yan, Y. Sun, “Hierarchically 3D Porous Ag Nanostructures Derived from Silver Benzenethiolate Nanoboxes: Enabling CO2 Reduction with a Near-Unity Selectivity and Mass-Specific Current Density over 500 A/g,” Nano Letters 20, 2806--2811 (2020). link
  6. C. Li, N. Ku, Y. Liu, J. Pan, B. Chai, F. Hu, M. Kornecki, Q. Yan, R. Brennan, S. Ren, “Magnetically active transition metal cation-substituted alumina,” Nanotechnology 31, 105703 (2020). link

2019

  1. L. Yu, A. Ruzsinszky, Q. Yan, “Chemisorption Can Reverse Defect–Defect Interaction on Heterogeneous Catalyst Surfaces,” The Journal of Physical Chemistry Letters 10, 7311--7317 (2019). link
  2. L. Yu, Q. Yan, A. Ruzsinszky, “Key role of antibonding electron transfer in bonding on solid surfaces,” Physical Review Materials 3, 092801 (2019). link
  3. J. Zeng, Y.-F. Zhang, W. Qin, P. Cui, Q. Yan, Z. Zhang, “Varying topological properties of two-dimensional honeycomb lattices composed of endohedral fullerenes,” Physical Review B 100, 045143 (2019). link
  4. N. K. Nepal, L. Yu, Q. Yan, A. Ruzsinszky, “First-principles study of mechanical and electronic properties of bent monolayer transition metal dichalcogenides,” Physical Review Materials 3, 073601 (2019). link
  5. W. Zhang, Y. Hu, J. Pan, J. Zhang, J. Cui, Q. Yan, S. Ren, “High current carrying and thermal conductive copper-carbon conductors,” Nanotechnology 30, 185701 (2019). link
  6. Y. Sun, J. Pan, Z. Zhang, K. Zhang, J. Liang, W. Wang, Z. Yuan, Y. Hao, B. Wang, J. Wang, Y. Wu, J. Zheng, L. Jiao, S. Zhou, K. Liu, C. Cheng, W. Duan, Y. Xu, Q. Yan, K. Liu, “Elastic Properties and Fracture Behaviors of Biaxially Deformed, Polymorphic MoTe2,” Nano Letters 19, 761--769 (2019). link

2018

  1. A. C. Thenuwara, L. Dheer, N. H. Attanayake, Q. Yan, U. V. Waghmare, D. R. Strongin, “Co‐Mo‐P Based Electrocatalyst for Superior Reactivity in the Alkaline Hydrogen Evolution Reaction,” ChemCatChem 10, 4832--4837 (2018). link
  2. Q. Zhou, P. Tang, S. Liu, J. Pan, Q. Yan, S.-C. Zhang, “Learning atoms for materials discovery,” Proceedings of the National Academy of Sciences 115, E6411--E6417 (2018). link
  3. J. Pan, Q. Yan, “Data-driven material discovery for photocatalysis: a short review,” Journal of Semiconductors 39, 071001 (2018). link
  4. D. Lee, H. Wang, B. A. Noesges, T. J. Asel, J. Pan, J.-W. Lee, Q. Yan, L. J. Brillson, X. Wu, C.-B. Eom, “Identification of a functional point defect in SrTiO3,” Physical Review Materials 2, 060403 (2018). link
  5. A. C. Thenuwara, N. H. Attanayake, J. Yu, J. P. Perdew, E. J. Elzinga, Q. Yan, D. R. Strongin, “Cobalt Intercalated Layered NiFe Double Hydroxides for the Oxygen Evolution Reaction,” The Journal of Physical Chemistry B 122, 847--854 (2018). link
  6. S. K. Suram, L. Zhou, A. Shinde, Q. Yan, J. Yu, M. Umehara, H. S. Stein, J. B. Neaton, J. M. Gregoire, “Alkaline-stable nickel manganese oxides with ideal band gap for solar fuel photoanodes,” Chemical Communications 54, 4625--4628 (2018). link

2017

  1. S. F. Weber, R. Chen, Q. Yan, J. B. Neaton, “Prediction of TiRhAs as a Dirac nodal line semimetal via first-principles calculations,” Physical Review B 96, 235145 (2017). link
  2. J. Wang, X. Sui, W. Shi, J. Pan, S. Zhang, F. Liu, S.-H. Wei, Q. Yan, B. Huang, “Prediction of Ideal Topological Semimetals with Triply Degenerate Points in the NaCu3Te2 Family,” Physical Review Letters 119, 256402 (2017). link
  3. A. Shinde, S. K. Suram, Q. Yan, L. Zhou, A. K. Singh, J. Yu, K. A. Persson, J. B. Neaton, J. M. Gregoire, “Discovery of Manganese-Based Solar Fuel Photoanodes via Integration of Electronic Structure Calculations, Pourbaix Stability Modeling, and High-Throughput Experiments,” ACS Energy Letters 2, 2307--2312 (2017). link
  4. C. M. Jones, C.-H. Teng, Q. Yan, P.-C. Ku, E. Kioupakis, “Impact of carrier localization on recombination in InGaN quantum wells and the efficiency of nitride light-emitting diodes: Insights from theory and numerical simulations,” Applied Physics Letters 111, 113501 (2017). link
  5. Q. Yan, J. Yu, S. K. Suram, L. Zhou, A. Shinde, P. F. Newhouse, W. Chen, G. Li, K. A. Persson, J. M. Gregoire, J. B. Neaton, “Solar fuels photoanode materials discovery by integrating high-throughput theory and experiment,” Proceedings of the National Academy of Sciences 114, 3040--3043 (2017). link
  6. C.-F. Wu, H. Wang, Q. Yan, T.-R. Wei, J.-F. Li, “Doping of thermoelectric PbSe with chemically inert secondary phase nanoparticles,” J. Mater. Chem. C 5, 10881--10887 (2017). link
  7. Y.-S. Guan, Z. Zhang, J. Pan, Q. Yan, S. Ren, “Rational design of molecular crystals for enhanced charge transfer properties,” Journal of Materials Chemistry C 5, 12338--12342 (2017). link
  8. L. Yu, Q. Yan, A. Ruzsinszky, “Negative Poisson's ratio in 1T-type crystalline two-dimensional transition metal dichalcogenides,” Nature Communications 8, 15224 (2017). link

2016

  1. C. Freysoldt, B. Lange, J. Neugebauer, Q. Yan, J. L. Lyons, A. Janotti, C. G. Van de Walle, “Electron and chemical reservoir corrections for point-defect formation energies,” Physical Review B 93, 165206 (2016). link
  2. A. Shinde, G. Li, L. Zhou, D. Guevarra, S. K. Suram, F. M. Toma, Q. Yan, J. A. Haber, J. B. Neaton, J. M. Gregoire, “The role of the CeO2/BiVO4 interface in optimized Fe–Ce oxide coatings for solar fuels photoanodes,” Journal of Materials Chemistry A 4, 14356--14363 (2016). link
  3. L. Zhou, Q. Yan, J. Yu, R. J. R. Jones, N. Becerra-Stasiewicz, S. K. Suram, A. Shinde, D. Guevarra, J. B. Neaton, K. A. Persson, J. M. Gregoire, “Stability and self-passivation of copper vanadate photoanodes under chemical, electrochemical, and photoelectrochemical operation,” Physical Chemistry Chemical Physics 18, 9349--9352 (2016). link

2015

  1. L. Zhou, Q. Yan, A. Shinde, D. Guevarra, P. F. Newhouse, N. Becerra‐Stasiewicz, S. M. Chatman, J. A. Haber, J. B. Neaton, J. M. Gregoire, “High Throughput Discovery of Solar Fuels Photoanodes in the CuO–V2O5 System,” Advanced Energy Materials 5, 1500968 (2015). link
  2. C. Pan, Q. Yan, H. Fu, Y. Zhao, Y. Wu, C. Van de Walle, S. Nakamura, S. P. DenBaars, “High optical power and low‐efficiency droop blue light‐emitting diodes using compositionally step‐graded InGaN barrier,” Electronics Letters 51, 1187--1189 (2015). link
  3. Q. Yan, G. Li, P. F. Newhouse, J. Yu, K. A. Persson, J. M. Gregoire, J. B. Neaton, “Mn2V2O7: An Earth Abundant Light Absorber for Solar Water Splitting,” Advanced Energy Materials 5, 1401840 (2015). link
  4. J. Yu, Q. Yan, W. Chen, A. Jain, J. B. Neaton, K. A. Persson, “First-principles study of electronic structure and photocatalytic properties of MnNiO3 as an alkaline oxygen-evolution photocatalyst,” Chemical Communications 51, 2867--2870 (2015). link

2014

  1. Q. Yan, A. Janotti, M. Scheffler, C. G. Van de Walle, “Origins of optical absorption and emission lines in AlN,” Applied Physics Letters 105, 111104 (2014). link
  2. Q. Yan, P. Rinke, A. Janotti, M. Scheffler, C. G. Van de Walle, “Effects of strain on the band structure of group-III nitrides,” Physical Review B 90, 125118 (2014). link
  3. Q. Yan, E. Kioupakis, D. Jena, C. G. Van de Walle, “First-principles study of high-field-related electronic behavior of group-III nitrides,” Physical Review B 90, 121201 (2014). link
  4. P. M. McBride, Q. Yan, C. G. Van de Walle, “Effects of In profile on simulations of InGaN/GaN multi-quantum-well light-emitting diodes,” Applied Physics Letters 105, 083507 (2014). link
  5. A. Alkauskas, Q. Yan, C. G. Van de Walle, “First-principles theory of nonradiative carrier capture via multiphonon emission,” Physical Review B 90, 075202 (2014). link
  6. K. Liu, Q. Yan, M. Chen, W. Fan, Y. Sun, J. Suh, D. Fu, S. Lee, J. Zhou, S. Tongay, J. Ji, J. B. Neaton, J. Wu, “Elastic Properties of Chemical-Vapor-Deposited Monolayer MoS2, WS2, and Their Bilayer Heterostructures,” Nano Letters 14, 5097--5103 (2014). link
  7. N. Wang, D. West, J. Liu, J. Li, Q. Yan, B.-L. Gu, S. B. Zhang, W. Duan, “Microscopic origin of the p-type conductivity of the topological crystalline insulator SnTe and the effect of Pb alloying,” Physical Review B 89, 045142 (2014). link

2013

  1. E. Kioupakis, Q. Yan, D. Steiauf, C. G. Van de Walle, “Temperature and carrier-density dependence of Auger and radiative recombination in nitride optoelectronic devices,” New Journal of Physics 15, 125006 (2013). link
  2. M. S. Miao, Q. M. Yan, C. G. Van de Walle, “Electronic structure of a single-layer InN quantum well in a GaN matrix,” Applied Physics Letters 102, 102103 (2013). link
  3. Y. Zhao, Q. Yan, D. Feezell, K. Fujito, C. G. Van de Walle, J. S. Speck, S. P. DenBaars, S. Nakamura, “Optical polarization characteristics of semipolar (303¯1) and (303¯1¯) InGaN/GaN light-emitting diodes,” Optics Express 21, A53 (2013). link
  4. E. Kioupakis, P. Rinke, A. Janotti, Q. Yan, C. Van de Walle, “Energy Conversion: Solid‐State Lighting,” Computational Approaches to Energy Materials, 231--259 (2013). link

2012

  1. E. Kioupakis, Q. Yan, C. G. Van de Walle, “Interplay of polarization fields and Auger recombination in the efficiency droop of nitride light-emitting diodes,” Applied Physics Letters 101, 231107 (2012). link
  2. M. S. Miao, Q. Yan, C. G. Van de Walle, W. K. Lou, L. L. Li, K. Chang, “Polarization-Driven Topological Insulator Transition in a GaN/InN/GaN Quantum Well,” Physical Review Letters 109, 186803 (2012). link
  3. Q. Yan, P. Rinke, M. Winkelnkemper, A. Qteish, D. Bimberg, M. Scheffler, C. G. Van de Walle, “Strain effects and band parameters in MgO, ZnO, and CdO,” Applied Physics Letters 101, 152105 (2012). link
  4. Y. Kawaguchi, C.-Y. Huang, Y.-R. Wu, Q. Yan, C.-C. Pan, Y. Zhao, S. Tanaka, K. Fujito, D. Feezell, C. G. Van de Walle, S. P. DenBaars, S. Nakamura, “Influence of polarity on carrier transport in semipolar (2021¯) and (202¯1) multiple-quantum-well light-emitting diodes,” Applied Physics Letters 100, 231110 (2012). link
  5. Y. Zhao, Q. Yan, C.-Y. Huang, S.-C. Huang, P. Shan Hsu, S. Tanaka, C.-C. Pan, Y. Kawaguchi, K. Fujito, C. G. Van de Walle, J. S. Speck, S. P. DenBaars, S. Nakamura, D. Feezell, “Indium incorporation and emission properties of nonpolar and semipolar InGaN quantum wells,” Applied Physics Letters 100, 201108 (2012). link
  6. Q. Yan, A. Janotti, M. Scheffler, C. G. Van de Walle, “Role of nitrogen vacancies in the luminescence of Mg-doped GaN,” Applied Physics Letters 100, 142110 (2012). link
  7. C. Roberts, Q. Yan, M.-S. Miao, C. G. Van de Walle, “Confinement effects on valence-subband character and polarization anisotropy in (112¯2) semipolar InGaN/GaN quantum wells,” Journal of Applied Physics 111, 073113 (2012). link

2011

  1. C.-Y. Huang, Q. Yan, Y. Zhao, K. Fujito, D. Feezell, C. G. Van de Walle, J. S. Speck, S. P. DenBaars, S. Nakamura, “Influence of Mg-doped barriers on semipolar (202¯1) multiple-quantum-well green light-emitting diodes,” Applied Physics Letters 99, 141114 (2011). link
  2. Y. Zhao, S. Tanaka, Q. Yan, C.-Y. Huang, R. B. Chung, C.-C. Pan, K. Fujito, D. Feezell, C. G. Van de Walle, J. S. Speck, S. P. DenBaars, S. Nakamura, “High optical polarization ratio from semipolar (202¯1¯) blue-green InGaN/GaN light-emitting diodes,” Applied Physics Letters 99, 051109 (2011). link
  3. P. G. Moses, M. Miao, Q. Yan, C. G. Van de Walle, “Hybrid functional investigations of band gaps and band alignments for AlN, GaN, InN, and InGaN,” The Journal of Chemical Physics 134, 084703 (2011). link
  4. Q. Yan, P. Rinke, M. Winkelnkemper, A. Qteish, D. Bimberg, M. Scheffler, C. G. Van de Walle, “Band parameters and strain effects in ZnO and group-III nitrides,” Semiconductor Science and Technology 26, 014037 (2011). link

2010

  1. Q. Yan, P. Rinke, M. Scheffler, C. G. Van de Walle, “Role of strain in polarization switching in semipolar InGaN/GaN quantum wells,” Applied Physics Letters 97, 181102 (2010). link

2009

  1. Q. Yan, P. Rinke, M. Scheffler, C. G. Van de Walle, “Strain effects in group-III nitrides: Deformation potentials for AlN, GaN, and InN,” Applied Physics Letters 95, 121111 (2009). link
  2. B. Huang, Q.-m. Yan, Z.-y. Li, W.-h. Duan, “Towards graphene nanoribbon-based electronics,” Frontiers of Physics in China 4, 269--279 (2009). link

2008

  1. J. Yu, Z. Wu, Z. Liu, Q. Yan, J. Wu, W. Duan, “Phase diagram of ferroelectric BaTiO3 ultrathin films under open-circuit conditions,” Journal of Physics: Condensed Matter 20, 135203 (2008). link

2007

  1. B. Huang, Q. Yan, G. Zhou, J. Wu, B.-L. Gu, W. Duan, F. Liu, “Making a field effect transistor on a single graphene nanoribbon by selective doping,” Applied Physics Letters 91, 253122 (2007). link
  2. Q. Yan, B. Huang, J. Yu, F. Zheng, J. Zang, J. Wu, B.-L. Gu, F. Liu, W. Duan, “Intrinsic Current−Voltage Characteristics of Graphene Nanoribbon Transistors and Effect of Edge Doping,” Nano Letters 7, 1469--1473 (2007). link
  3. H. Liu, G. Zhou, Q. Yan, J. Wu, B.-L. Gu, W. Duan, D.-L. Zhao, “Structural and electronic properties of fluorinated double-walled boron nitride nanotubes: Effect of interwall interaction,” Physical Review B 75, 125410 (2007). link

2006

  1. Q. Yan, G. Zhou, S. Hao, J. Wu, W. Duan, “Mechanism of nanoelectronic switch based on telescoping carbon nanotubes,” Applied Physics Letters 88, 173107 (2006). link

2005

  1. Q. Yan, J. Wu, G. Zhou, W. Duan, B.-L. Gu, “Ab initio study of transport properties of multiwalled carbon nanotubes,” Physical Review B 72, 155425 (2005). link