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S掺杂2H-CuGaO_(2)结构与性能的第一性原理研究
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作者 毕毓嘉 刘文婷 《全面腐蚀控制》 2023年第11期61-64,共4页
基于第一性原理的密度泛函理论平面波超软赝势方法,研究不同浓度S掺杂对2H-CuGaO_(2)能带结构和电子特性的影响规律。结果表明,掺杂后2H-CuGaO_(2)仍是间接带隙半导体,且带隙值随着掺杂浓度增加而增加;掺杂过程形成费米能级,对2H-CuGaO_... 基于第一性原理的密度泛函理论平面波超软赝势方法,研究不同浓度S掺杂对2H-CuGaO_(2)能带结构和电子特性的影响规律。结果表明,掺杂后2H-CuGaO_(2)仍是间接带隙半导体,且带隙值随着掺杂浓度增加而增加;掺杂过程形成费米能级,对2H-CuGaO_(2)导电性产生影响。 展开更多
关键词 2H-cugao_(2) 第一性原理 电子特性 掺杂
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水热法制备C_(3)N_(4)/CuGaO_(2)复合物及其气敏性能
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作者 王春水 吴海燕 +3 位作者 焦成 储向峰 梁士明 何丽芳 《稀有金属材料与工程》 SCIE EI CAS CSCD 北大核心 2024年第6期1536-1542,共7页
采用简单水热法合成了一系列C_(3)N_(4)/CuGaO_(2)复合材料。采用XRD、SEM、TEM和XPS对制备的样品进行了表征。研究了一系列C_(3)N_(4)/Cu GaO_(2)复合材料的气敏性能。结果表明,基于C_(3)N_(4)/CuGaO_(2)-0.3复合材料(C_(3)N_(4)与Cu G... 采用简单水热法合成了一系列C_(3)N_(4)/CuGaO_(2)复合材料。采用XRD、SEM、TEM和XPS对制备的样品进行了表征。研究了一系列C_(3)N_(4)/Cu GaO_(2)复合材料的气敏性能。结果表明,基于C_(3)N_(4)/CuGaO_(2)-0.3复合材料(C_(3)N_(4)与Cu GaO_(2)的摩尔比为0.3:1)的气体传感器对甲苯的传感性能优于CuGaO_(2)传感器。相比较于CuGaO_(2)传感器的工作温度(140℃),C_(3)N_(4)/CuGaO_(2)-0.3复合材料传感器的最佳工作温度仅为25℃,对100μL/L甲苯气体的响应达到28,检出限低至0.01μL/L。对100μL/L甲苯气体的响应时间和恢复时间分别为114.2和27.4s。此外,用于检测甲苯的C_(3)N_(4)/CuGaO_(2)-0.3复合材料传感器还具有优异的长期稳定性、良好的重复性和优异的抗湿性能。 展开更多
关键词 C_(3)N_(4) cugao_(2) 气体传感器 甲苯
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Hydrothermal synthesized delafossite CuGaO_(2) as an electrocatalyst for water oxidation
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作者 Han Gao Miao Yang +3 位作者 Xing Liu Xianglong Dai Xiao-Qing Bao Dehua Xiong 《Frontiers of Optoelectronics》 EI CSCD 2022年第1期80-91,共12页
Hydrogen production from water splitting provides an effective method to alleviate the ever-growing global energy crisis.In this work,delafossite CuGaO_(2)(CGO)crystal was synthesized through hydrothermal routes with ... Hydrogen production from water splitting provides an effective method to alleviate the ever-growing global energy crisis.In this work,delafossite CuGaO_(2)(CGO)crystal was synthesized through hydrothermal routes with Cu(NO_(3))_(2)·3H_(2)O and Ga(NO_(3))_(3)·xH_(2)O used as reactants.The addition of cetyltrimethylammonium bromide(CTAB)was found to play an important role in modifying the morphology of CuGaO_(2)(CGO-CTAB).With the addition of CTAB,the morphology of CGO-CTAB samples changed from irregular flake to typical hexagonal sheet microstructure,with an average size of 1-2μm and a thick-ness of around 100 nm.Furthermore,the electrocatalytic activity of CGO-CTAB crystals for oxygen evolution reaction(OER)was also studied and compared with that of CGO crystals.CGO-CTAB samples exhibited better activity than CGO.An overpotential of 391.5 mV was shown to be able to generate a current density of 10 mA/cm^(2).The as-prepared samples also demonstrate good stability for water oxidation and relatively fast OER kinetics with a Tafel slope of 56.4 mV/dec.This work highlights the significant role of modification of CTAB surfactants in preparing CGO related crystals,and the introduc-tion of CTAB was found to help to improve their electrocatalytic activity for OER. 展开更多
关键词 HYDROTHERMAL Water splitting DELAFOSSITE cugao_(2)(CGO) ELECTROCATALYST
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