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Dantong Zhang, Qi Zhang, Chao Peng, Zhi Long, Guilin Zhuang, Denis Kramer, Sridhar Komarneni, Chunyi Zhi, Dongfeng Xue. Recent advances in developing multiscale descriptor approach for the design of oxygen redox electrocatalysts. ISCIENCE[J]. 2023, 26(5): 106624-, https://doaj.org/article/4b2f9c1c5c724fc7843cac565825dd46.
彭超. Co‐Free Layered Oxide Cathode Material with Stable Anionic Redox Reaction for Sodium‐Ion Batteries. Advanced Energy Materials[J]. 2023,
Liang, Ziwei, Peng, Chao, Shen, Jiadong, Yang, Yan, Yao, Shiyan, Xue, Dongfeng, Zhu, Min, Liu, Jun. Lithiophilic single-atom Co on carbon nanosheets synergistically modulates Li deposition enable dendrite-free lithium metal batteries. JOURNAL OF POWER SOURCES[J]. 2023, 556: http://dx.doi.org/10.1016/j.jpowsour.2022.232474.
彭超. Origin of oxygen-redox and transition metals dissolution in Ni-rich LixNi0. 8Co0. 1Mn0. 1O2 cathode. The Journal of Chemical Physics[J]. 2023,
彭超. Data-driven Discovery and Intelligent Design of Artificial Hybrid Interphase Layer for Stabilizing Lithium Metal Anode. Matter[J]. 2023,
彭超. Regulating Electron Distribution of P2-Type Layered Oxide Cathodes for Practical Sodium-Ion Batteries. Materials Today[J]. 2023,
彭超. Rationa Design of Electrolyte Solvation Structures for Modulating 2e−/4e− Transfer in Sodium–Air Batteries. Advanced Functional Materials[J]. 2022,
Alkaline Tolerant Antifreezing Additive Enabling Aqueous Zn||Ni Battery Operating at -60°C. Angewandte Chemie International Edition[J]. 2022,
彭超. Boosting fast and stable symmetric sodium-ion storage by synergistic engineering and amorphous structure. Nano Energy[J]. 2022,
Defect-Induced Dense Amorphous/Crystalline Heterophase Enables High-Rate and Ultra-Stable Sodium Storage. Advanced Science[J]. 2022,
Huang, Wei, Peng, Chao, Tang, Jing, Diao, Fangyuan, Yesibolati, Murat Nulati, Sun, Hongyu, Engelbrekt, Christian, Zhang, Jingdong, Xiao, Xinxin, Molhave, Kristian S. Electronic structure modulation with ultrafine Fe3O4 nanoparticles on 2D Ni-based metal-organic framework layers for enhanced oxygen evolution reaction. JOURNAL OF ENERGY CHEMISTRY[J]. 2022, 65(2): 78-88, https://www.sciengine.com/doi/10.1016/j.jechem.2021.05.030.
Peng Chao. Carbon stacking hysteresis during lithiation/delithiation of graphite. Journal of Materials Chemistry A. 2021,
Peng Chao. High-loading single-atom silver catalyst with Ag1-C2N1 structure showing superior performance for epoxidation of styrene. ACS Catalysis. 2021,
Tian, Shubo, Peng, Chao, Dong, Juncai, Xu, Qi, Chen, Zheng, Zhai, Dong, Wang, Yu, Gu, Lin, Hu, P, Duan, Haohong, Wang, Dingsheng, Li, Yadong. High-Loading Single-Atomic-Site Silver Catalysts with an Ag-1-C2N1 Structure Showing Superior Performance for Epoxidation of Styrene. ACS CATALYSIS[J]. 2021, 11(9): 4946-4954, http://dx.doi.org/10.1021/acscatal.1c00455.
Cao, Huili, Peng, Chao, Zheng, Zhiyong, Lan, Zhenyun, Pan, Qinying, Nielsen, Ulla Gro, Norby, Poul, Xiao, Xinxin, Mossin, Susanne. Orientation effect of zinc vanadate cathode on zinc ion storage performance. ELECTROCHIMICA ACTA[J]. 2021, 388: http://dx.doi.org/10.1016/j.electacta.2021.138646.
Peng, Chao, Bhandari, Arihant, Dziedzic, Jacek, Owen, John R, Skylaris, ChrisKriton, Kramer, Denis. Mechanism of Li nucleation at graphite anodes and mitigation strategies. JOURNAL OF MATERIALS CHEMISTRY A[J]. 2021, 9(31): 16798-16804, http://dx.doi.org/10.1039/d1ta03447b.
Peng, Chao, Chen, Jianfu, Hu, Peijun, Wang, Haifeng. Molecular Adsorption Kinetics: Nonlinear Entropy-Enthalpy Loss Quantified by Constrained AIMD and Insights into the Adsorption-Site Determination on Metal Oxides. JOURNAL OF PHYSICAL CHEMISTRY C[J]. 2021, 125(20): 10974-10982, http://dx.doi.org/10.1021/acs.jpcc.1c02537.
Li, Zhi, Chen, Yuanjun, Ji, Shufang, Tang, Yan, Chen, Wenxing, Li, Ang, Zhao, Jie, Xiong, Yu, Wu, Yuen, Gong, Yue, Yao, Tao, Liu, Wei, Zheng, Lirong, Dong, Juncai, Wang, Yu, Zhuang, Zhongbin, Xing, Wei, He, ChunTing, Peng, Chao, Cheong, WengChon, Li, Qiheng, Zhang, Maolin, Chen, Zheng, Fu, Ninghua, Gao, Xin, Zhu, Wei, Wan, Jiawei, Zhang, Jian, Gu, Lin, Wei, Shiqiang, Hu, Peijun, Luo, Jun, Li, Jun, Chen, Chen, Peng, Qing, Duan, Xiangfeng, Huang, Yu, Chen, XiaoMing, Wang, Dingsheng, Li, Yadong. Iridium single-atom catalyst on nitrogen-doped carbon for formic acid oxidation synthesized using a general host-guest strategy. NATURE CHEMISTRY[J]. 2020, 12(8): http://dx.doi.org/10.1038/s41557-020-0473-9.
Ding, Yunxuan, Shen, Yujie, Peng, Chao, Huang, Meilan, Hu, P. Unraveling the Photogenerated Electron Localization on the Defect-Free CH3NH3PbI3(001) Surfaces: Understanding and Implications from a First-Principles Study. JOURNAL OF PHYSICAL CHEMISTRY LETTERS[J]. 2020, 11(19): 8041-8047, https://www.webofscience.com/wos/woscc/full-record/WOS:000577152900017.
Peng, Chao, Mercer, Michael P, Skylaris, ChrisKriton, Kramer, Denis. Lithium intercalation edge effects and doping implications for graphite anodes. JOURNAL OF MATERIALS CHEMISTRY A[J]. 2020, 8(16): 7947-7955, http://dx.doi.org/10.1039/c9ta13862e.
Bhandari, Arihant, Anton, Lucian, Dziedzic, Jacek, Peng, Chao, Kramer, Denis, Skylaris, ChrisKriton. Electronic structure calculations in electrolyte solutions: Methods for neutralization of extended charged interfaces. JOURNAL OF CHEMICAL PHYSICS[J]. 2020, 153(12): http://dx.doi.org/10.1063/5.0021210.
Peng Chao. A practical approach to large scale electronic structure calculations in electrolyte solutions via continuum-embedded linear-scaling DFT. The Journal of Physical Chemistry C. 2020,
Zheng, YanZhen, Li, XiTao, Zhao, ErFei, Lv, XinDing, Meng, FanLi, Peng, Chao, Lai, XueSen, Huang, Meilan, Cao, Guozhong, Tao, Xia, Chen, JianFeng. Hexamethylenetetramine-mediated growth of grain-boundary-passivation CH3NH3PbI3 for highly reproducible and stable perovskite solar cells. JOURNAL OF POWER SOURCES[J]. 2018, 377: 103-109, http://dx.doi.org/10.1016/j.jpowsour.2017.12.011.
Peng, Chao, Chen, Jianfu, Wang, Haifeng, Hu, P. First-Principles Insight into the Degradation Mechanism of CH3NH3PbI3 Perovskite: Light-Induced Defect Formation and Water Dissociation. JOURNAL OF PHYSICAL CHEMISTRY C[J]. 2018, 122(48): 27340-27349, https://www.webofscience.com/wos/woscc/full-record/WOS:000452693300025.
Peng, Chao, Reid, Glenn, Wang, Haifeng, Hu, P. Perspective: Photocatalytic reduction of CO2 to solar fuels over semiconductors. JOURNAL OF CHEMICAL PHYSICS[J]. 2017, 147(3): https://www.webofscience.com/wos/woscc/full-record/WOS:000406129100001.
Peng, Chao, Wang, Jinglin, Wang, Haifeng, Hu, P. Unique Trapped Dimer State of the Photogenerated Hole in Hybrid Orthorhombic CH3NH3PbI3 Perovskite: Identification, Origin, and Implications. NANO LETTERS[J]. 2017, 17(12): 7724-7730, https://www.webofscience.com/wos/woscc/full-record/WOS:000418393300076.
Zhang, Jiawei, Peng, Chao, Wang, Haifeng, Hu, P. Identifying the Role of Photogenerated Holes in Photocatalytic Methanol Dissociation on Rutile TiO2(110). ACS CATALYSIS[J]. 2017, 7(4): 2374-2380, https://www.webofscience.com/wos/woscc/full-record/WOS:000398986700015.
彭超. Ni/Ce0.75Zr0.25O2界面催化 CO2甲烷化密度泛函理论研究. 中国科学：化学. 2016,
Peng Chao. Theoretical insights into how the first C–C bond forms in the methanol-to-olefin process catalyzed by HSAPO-34. Physical Chemistry Chemical Physics. 2016,
Li, Yu Hang, Peng, Chao, Yang, Shuang, Wang, Hai Feng, Yang, Hua Gui. Critical roles of co-catalysts for molecular hydrogen formation in photocatalysis. JOURNAL OF CATALYSIS[J]. 2015, 330: 120-128, https://www.webofscience.com/wos/woscc/full-record/WOS:000362603200011.
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