新能源

新能源材料设计（光电和热电材料），半导体缺陷及掺杂研究

[1] Han, D.* †; Zhu, B. †; Cai, Z; Spooner, K.; Rudel, S. S.; Schnick, W.; Bein, T.; Scanlon., D.*; Ebert, H., Discovery of multi-anion antiperovskite X6NFSn2 (X = Ca, Sr) as promising thermoelectric materials by computational screening. Matter 2024, 7 (1), 158-174
[2] Wang, S.,; Han, D.*; Maheu, C; Hooijer, R.; Mayer, T.; Hartschuh, A.; Ebert, H.; Bein T.*, Room-temperature synthesis of lead-free copper (I)-antimony (III)-based double perovskite nanocrystals. APL Materials, 2023, 11(4), 041110. (编辑推荐论文)
[3] Han, D.*; Rudel, S. S.; Schnick, W.; Ebert, H., Self-Doping Behavior and Cation Disorder in MgSnN2. Phys. Rev. B. 2022, 105 (12), 125202.
[4] Han, D.*; Feng, C.; Du, M.-H.; Zhang, T.; Wang, S.; Tang, G.*; Bein, T.; Ebert, H., Design of High-Performance Lead-Free Quaternary Antiperovskites for Photovoltaics via Ion Type Inversion and Anion Ordering. J. Am. Chem. Soc. 2021, 143 (31), 12369-12379.
[5] Guo, R.†; Han, D. †; Chen, W. †; Dai, L.; Ji, K.; Xiong, Q.; Li, S.; Reb, L. K.; Scheel, M. A.; Pratap, S.; et. al., Degradation Mechanisms of Perovskite Solar Cells under Vacuum and One Atmosphere of Nitrogen. Nat. Energy. 2021, 6 (10): 977-986. （期刊封面、ESI高被引论文）
[6] Han, D.*; Ebert, H., Identification of Potential Optoelectronic Applications for Metal Thiophosphates. ACS Appl. Mater. Interfaces 2021, 13 (3), 3836-3844.
[7] Han, D.; Chen, S.*; Du, M.-H.*, Role of Polycyclic Aromatic Alkylammonium Cations in Tuning the Electronic Properties and Band Alignment of Two-Dimensional Hybrid Perovskite Semiconductors. J. Phys. Chem. Lett. 2021, 12(40), 9754-9760.
[8] Han, D.†; Zhang, T. †; Chen, S.*, High-Throughput First-Principles Screening of Layered Magnetic Double Perovskites Cs4MSb2X12 for Spintronic Applications. J. Phys.: Condens. Matter 2020, 32 (22), 225705.
[9] Han, D.*; Ogura, M.; Held, A.; Ebert, H., Unique Behavior of Halide Double Perovskites with Mixed Halogens. ACS Appl. Mater. Interfaces 2020, 12 (33), 37100-37107.
[9] Han, D.; Ming, W.; Xu, H.; Chen, S.*; Sun, D.; Du, M.-H.*, Chemical Trend of Transition-Metal Doping in WSe2. Phys. Rev. Appl. 2019, 12 (3), 034038.
[10] Han, D. †; Shi, H.* †; Ming, W.; Zhou, C.; Ma, B.; Saparov, B.; Ma, Y.-Z.; Chen, S.; Du, M.-H.*, Unraveling Luminescence Mechanisms in Zero-Dimensional Halide Perovskites. J. Mater. Chem. C 2018, 6, 6398-6405.