{"id":171126,"date":"2019-03-28T11:36:41","date_gmt":"2019-03-28T03:36:41","guid":{"rendered":"\/\/m.iemloyee.com\/?p=171126"},"modified":"2019-03-27T22:36:53","modified_gmt":"2019-03-27T14:36:53","slug":"adv-mater-%ef%bc%9a%e9%92%99%e9%92%9b%e7%9f%bf%e4%b9%8b%e5%a4%96%e7%9a%84%e6%96%b0%e5%9e%8b%e5%a4%aa%e9%98%b3%e8%83%bd%e7%94%b5%e6%b1%a0%e6%9d%90%e6%96%99%e4%bd%93%e7%b3%bb%e7%9a%84%e7%90%86%e8%ae%ba","status":"publish","type":"post","link":"\/\/m.iemloyee.com\/?p=171126","title":{"rendered":"Adv. Mater.\uff1a\u9499\u949b\u77ff\u4e4b\u5916\u7684\u65b0\u578b\u592a\u9633\u80fd\u7535\u6c60\u6750\u6599\u4f53\u7cfb\u7684\u7406\u8bba\u63a2\u7d22"},"content":{"rendered":"

\u3010\u5f15\u8a00\u3011<\/p>\n

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\u3010\u6210\u679c\u7b80\u4ecb\u3011<\/p>\n

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\u3010\u56fe\u6587\u5bfc\u8bfb\u3011<\/p>\n

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\"\"<\/p>\n

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(b)\u9633\u79bb\u5b50-\u9634\u79bb\u5b50\u534a\u5f84\u5e73\u9762\u56fe\u4e2d\u6240\u6709\u53ef\u80fd\u7684MXn<\/sub>\u7ed3\u6784\uff0c\u6839\u636e\u79bb\u5b50\u6676\u4f53\u7684\u7acb\u4f53\u5316\u5b66\uff0c\u7528\u70b9\u5212\u7ebf\u533a\u5206\u4e0d\u540c\u7684\u914d\u4f4d\u6570\uff1b<\/p>\n

(c)\u5bf982\u79cd\u5178\u578b\u4e8c\u5143\u5316\u5408\u7269\u8ba1\u7b97\uff0c\u7ed3\u679c\u663e\u793a\u5171\u4ef7\u548c\u79bb\u5b50\u4f53\u7cfb\u5206\u522b\u503e\u5411\u4e8e\u5f62\u6210\u56db\u9762\u4f53\u914d\u4f4d\u7ed3\u6784\u548c\u516b\u9762\u4f53\u914d\u4f4d\u7ed3\u6784\u3002<\/p>\n

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\"\"<\/p>\n

(a-c) \u5206\u522b\u662f\u5c16\u6676\u77f3\u3001\u53cd\u5c16\u6676\u77f3\u548cPnma\u76f8\uff1b<\/p>\n

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\"\"(a)MgAl2<\/sub>S4<\/sub>\uff08\u7b2c\u4e00\u7c7b\uff09\uff1b<\/p>\n

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(c)HgAl2<\/sub>S4<\/sub>\uff08\u7b2c\u4e09\u7c7b\uff09\uff1b<\/p>\n

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\u56fe5\uff1a61\u79cd\u5c16\u6676\u77f3\u5316\u5408\u7269\u7684\u5e26\u9699\u548c\u5f62\u6210\u7113\u5173\u7cfb\u56fe\u3002<\/p>\n

\"\"(a)PBE\u8ba1\u7b9761\u79cd\u5c16\u6676\u77f3\u5316\u5408\u7269\u7684\u5f62\u6210\u80fd\u548c\u5e26\u9699\uff1b<\/p>\n

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\"\"(a)\u8ba1\u7b9710\u79cd\u5c16\u6676\u77f3\u5316\u5408\u7269\u7684\u5149\u5438\u6536\u8c31\uff1b<\/p>\n

(b)\u8ba1\u7b9710\u79cd\u5c16\u6676\u77f3\u5316\u5408\u7269\u7684\u5149\u8c31\u6709\u9650\u6700\u5927\u6548\u7387\uff1b<\/p>\n

(c-e) HgAl2<\/sub>Se4<\/sub>\uff0cZnSc2<\/sub>Se4\u548cCH3<\/sub>NH3<\/sub>PbI3<\/sub>\u7684VBM\u548cCBM\u7684\u8f68\u9053\u7279\u5f81\u3002<\/p>\n

\u56fe7\uff1aCdIn2<\/sub>Se4<\/sub>\uff0cHgAl2<\/sub>Se4<\/sub>\uff0cHgIn2<\/sub>S4<\/sub>\uff0cHgSc2<\/sub>S4<\/sub>\u548cHgY2<\/sub>S4<\/sub>\u57280K\u548c300K\u4e0b\u7684\u58f0\u5b50\u8c31\u8ba1\u7b97\u7ed3\u679c\u3002<\/p>\n

\"\"<\/p>\n

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    \n
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  2. Qingde Sun, Jiang Wang, Wan-Jian Yin*, Yanfa Yan*. Bandgap Engineering of Stable Lead-Free Oxide Double Perovskites for Photovoltaics. Adv. Mater., 2018, 1705901.<\/li>\n
  3. Qichen Xu, Zhenzhu Li, Wan-Jian Yin*. Rationalizing perovskite data for machine learning and materials design. J. Phys. Chem. Lett., 2018, 9, 6948-6954.<\/li>\n
  4. Wan-Jian Yin, Baicheng Weng, Jie Ge, Qingde Sun, Zhenzhu Li, Yanfa Yan*. Oxide perovskites, double perovskites and derivatives for electrocatalysis, photocatalysis, and photovoltaics. Energy Environ. Sci., 2019, 12, 442.<\/li>\n
  5. Qingde Sun, Hangyan Chen, Wan-Jian Yin*. Do chalcogenide double perovskites work as solar cell absorbers: A first-principles study. Chem. Mater.,2019, 31, 244-250.<\/li>\n
  6. Zhenzhu Li, Qichen Xu, Qingde Sun. Zhufeng Hou and Wan-Jian Yin*. Thermodynamic Stability Landscape of Halide Double Perovskites via High-Throughput Computing and Machine Learning, Adv. Fun. Mater. 2019, 29, 1807280.<\/li>\n<\/ol>\n

    \u6587\u732e\u94fe\u63a5\uff1aMaterials Design of Solar Cell Absorbers Beyond Perovskites and Conventional Semiconductors via Combining Tetrahedral and Octahedral Coordination<\/a>\uff08Adv. Mater.\uff0c2019\uff0cDOI\uff1a10.1002\/adma.201806593\uff09<\/p>\n

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