Tao, Shuxia - Eindhoven University of Technology

个人简介

With a Physical Chemistry background from Nankai University in China, Shuxia Tao started her PhD in 2007 at Department of Chemical Engineering and Chemistry, TU/e, the Netherlands. There she learnt Computational Materials Science and obtained her PhD in 2011 with a thesis on metal hydrides for battery applications. After a short career break to care for her children, she worked as post-doctoral researcher at NWO physics institute NIKHEF for materials design for photodetectors from 2013 to 2016.

研究领域

she currently leads the Computational Materials Physics Group with a focus on perovskite solar cells at Materials Simulation & Modelling, Department of Applied Physics

近期论文

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M. Pols, J.M. Vicent-Luna, I. Filot, A.C.T. van Duin, S. Tao*, Atomistic insights into the degradation of halide perovskites: a reactive force field molecular dynamics study, arXiv:2104.01455, 2021. J.M. Vicent-Luna, S. Apergi, S. Tao*, Efficient Computation of Metal Halide Perovskites Properties using the Extended Density Functional Tight Binding: GFN1-xTB Method, arXiv:2104.01738, 2021. H. Xue, G. Brocks, S Tao*, Comparison of different functionals for density functional theory calculations of defects in metal halide perovskites, arXiv:2104.01087, 2021. K. Datta, B. T. van Gorkom, Z. Chen, S. Tao, P. A. Bobbert, M. M. Wienk, R. A. J. Janssen, et al. The Effect of Light-Induced Halide Segregation in Mixed-Halide Perovskite Solar Cells, submitted. J. Zhang; R. Li; S. Apergi; G. Brocks; Y. Zhao; S. Tao*, X. Zhang*, Multi-functional molecule engineered SnO2 for efficient and lead-locked perovskite solar cells, submitted. Y. H. Robin Chang, J. Jiang, H. ye. Khong, I. Saad, S. S. Chai, M. M. Mahat, S. Tao, Stretchable AgX (X = Se, Te) for Efficient Thermoelectrics and Photovoltaics, ACS Applied Materials & Interfaces, (2021). Z. Chen, G. Brocks, S. Tao*, P. A. Bobbert*, Unified theory for light-induced halide segregation in mixed halide perovskites, Nature Communications, 12, 2687(2021). H. Xie, Z. Wang, Z. Chen, M. Pols, S. Stranks, S. Tao, M. Grätzel, A. Hagfeldt, M. L. Cantu, et al. Phosphonates immobilize ions under non-equilibrium conditions in highly stable halide perovskite solar cells, Joule, 5, 1246(2021). F. Liu, J. Jiang, T. Toyoda, M. K. Kamarudin, S. Hayase, R. Wang, S. Tao*, Q. Shen*, K. Jan*, Ultra-Halide-Rich Synthesis of Stable Pure Tin-Based Halide Perovskite Quantum Dots: Implications for Photovoltaics, ACS Applied Nano Materials, 4, 3958(2021). J. Jiang, F. Liu, Q. Shen*, S. Tao*, The Role of Sodium in Stabilizing Tin-Lead (Sn-Pb) Alloyed Perovskite Quantum Dots, J. Mater. Chem. A. 9, 12087(2021). C. Onwudinanti, G. Brocks, V. Koelman, T. Morgan, S. Tao*, Tin deposition on ruthenium and its influence on blistering in multi-layer mirrors, submitted to Physical Chemistry Chemical Physics. M. He, C. Onwudinanti,Y. Zheng, Y. Zheng, X. Wu, Z. Zhang*, S. Tao*, Ab initio study of metal carbide hydrides in 2.25Cr1Mo0.25V steel, Physical Chemistry Chemical Physics, 23, 5199(2021). Y. Guo, S. Apergi, N. Li, M. Chen, C. Yin, Z. Yuan, F. Gao, F. Xie, G. Brocks, S. Tao*, N. Zhao*, Phenylalkylammonium passivation enables perovskite light emitting diodes with record high-radiance operational lifetime: the chain length matters, Nature Communications, 12:644(2021). Q. Li, Z. Chen, I. Tranca, S. Gaastra-Nedea, D. Smeulders and S. Tao*, Compositional effect on water adsorption on metal halide perovskites, Applied Surface Science, 538, 148058(2021). Y. Song, N. Wang, M. M. Fadlallah, S. Tao*, Y. Yang*, Z. L. Wang*, Direct-current nanogenerator based on nanoscale contact electrification on ZnO nanowire array, Nano Energy, 79, 105406(2021). J. Jiang, F. Liu, I. Tranca, Q. Shen, S. Tao*, Atomistic and electronic origin of phase instability of metal halide perovskites, ACS Appl. Energy Mater. 3, 12, 11548–11558 (2020). M. Qin, H. Xue, H. Zhang, G. Brocks, S. Tao*, X. Lu* et al. Precise control of perovskite crystallization kinetics via sequential A-site doping, Advanced Materials, 2004630 (2020). S. Apergi, G. Brocks, S. Tao*, Tuning the Electronic Levels of NiO with Alkali Halides Surface Modiers for Perovskite Solar Cells, Physical Review Materials, 4, 085403 (2020). J. Cao, J. Jiang, N. Li, Y. Dong, Y. Jia, S. Tao*, Ni Zhao*, Alkali-Cation-Enhanced Benzylammonium Passivation for Efficient and Stable Perovskite Solar Cells Fabricated Through Sequential Deposition, J. Mater. Chem. A, 8, 19357-19366 (2020). H. Sudrajat, M. Fadlallah, S. Tao, M. Kitta, N. Ichikuni, H. Onishi, Dopant site in indium-doped SrTiO3 photocatalysts, Physical Chemistry Chemical Physics, 22, 19178-19187 (2020).