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Mn、Zn、Sn掺杂CsPbI_(3)的稳定性和光电性质研究
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作者 张仁杰 陶红帅 郝启圣 《原子与分子物理学报》 CAS 北大核心 2025年第2期182-188,共7页
采用基于密度泛函理论的第一性原理,计算了本征CsPbI_(3)和Mn、Zn、Sn掺杂体系的形成能、电子结构和光学性质.研究结果表明:Mn、Zn、Sn的掺入减小了材料晶格常数,Mn原子掺入CsPbI_(3)晶体结构使得体系的磁矩由0变为5.00μ_(B),丰富了材... 采用基于密度泛函理论的第一性原理,计算了本征CsPbI_(3)和Mn、Zn、Sn掺杂体系的形成能、电子结构和光学性质.研究结果表明:Mn、Zn、Sn的掺入减小了材料晶格常数,Mn原子掺入CsPbI_(3)晶体结构使得体系的磁矩由0变为5.00μ_(B),丰富了材料磁性.与Zn掺杂体系相比,Mn、Sn掺杂体系更为稳定.Mn掺杂体系增大了材料带隙,Zn、Sn的掺入使材料带隙分别减小了30.2%和16.2%,有利于电子极化跃迁,但Zn掺入使CsPbI_(3)材料转变为间接带隙半导体.在可见光区域中Mn、Zn、Sn掺杂体均表现出优异的光学性能,Sn掺杂体系效果最佳.这些研究结果为实验方面CsPbI_(3)材料的掺杂改性提供了数据支持,有利于CsPbI_(3)钙钛矿在光电领域的应用. 展开更多
关键词 cspbi_(3) 第一性原理 电子结构 光学性质
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Dimethylamine oxalate manipulating CsPbI_(3) perovskite film crystallization process for high efficiency carbon electrode based perovskite solar cells
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作者 Wenran Wang Xin Peng +7 位作者 Jianxin Zhang Jiage Lin Rong Huang Guizhi Zhang Huishi Guo Zhenxiao Pan Xinhua Zhong Huashang Rao 《Journal of Energy Chemistry》 SCIE EI CAS CSCD 2024年第6期221-228,I0006,共9页
Crystallization process determines the quality of perovskite films and the performances of resultant perovskite solar cells(PSCs).Dimethylamine oxalate has been proven as a multifunctional modulator,and is explored as... Crystallization process determines the quality of perovskite films and the performances of resultant perovskite solar cells(PSCs).Dimethylamine oxalate has been proven as a multifunctional modulator,and is explored as an efficient additive in manipulating the crystallization process of CsPbI_(3) perovskite films.On one hand,oxalate serves as the precipitator that facilitates the nucleation process of intermediate.The larger size of intermediate is conductive to the larger size and smaller grain boundaries of resultant perovskite.On the other hand,in subsequent annealing process,the phase conversion and growth process of transient perovskite can be decelerated due to the strong interactions of oxalate with both dimethylamine cation(DMA^(+))and Pb^(2+).Due to the optimized crystallization kinetics,the morphology and quality of CsPbI_(3) perovskite films are comprehensively improved with lower defect concentrations,and charge recombination loss is effectively suppressed.Benefiting from the optimized crystal quality of perovskite films,the carbon electrode-based CsPbI_(3) PSCs exhibit a champion efficiency of 18.48%.This represents one of the highest levels among all hole transport layer-free inorganic perovskite solar cells. 展开更多
关键词 Solar cells perovskite cspbi_(3) Carbon electrodes OXALATE
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基于有机胺盐表面修饰的CsPbI_(3)全无机钙钛矿太阳能电池性能的提升 被引量:1
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作者 柳宇 徐凌波 崔灿 《浙江理工大学学报(自然科学版)》 2024年第2期145-152,共8页
有机胺盐表面修饰是钙钛矿太阳能电池中钝化钙钛矿表面缺陷和提升电池稳定性的有效方法。旋涂苯乙基碘化铵(phenylethylammonium iodide,PEAI)和四丁基碘化铵(tetrabutylammonium iodide,TBAI)溶液在CsPbI_(3)钙钛矿薄膜表面并进行热处... 有机胺盐表面修饰是钙钛矿太阳能电池中钝化钙钛矿表面缺陷和提升电池稳定性的有效方法。旋涂苯乙基碘化铵(phenylethylammonium iodide,PEAI)和四丁基碘化铵(tetrabutylammonium iodide,TBAI)溶液在CsPbI_(3)钙钛矿薄膜表面并进行热处理,修饰钙钛矿表面,采用X射线衍射仪、扫描电镜、稳态-瞬态荧光寿命光谱仪对薄膜的结构形貌和光电性能进行表征分析,通过电流密度-电压测试、电化学阻抗测试和暗态电流密度-电压测试对比两种表面修饰剂对CsPbI_(3)钙钛矿薄膜和器件性能的影响。结果表明:PEAI不能与CsPbI_(3)发生离子交换生成低维钙钛矿,仅通过吸附在表面钝化缺陷并阻碍水汽侵入,提升薄膜的稳定性;而TBAI可有效进入无机CsPbI_(3)钙钛矿晶格,形成低维钙钛矿相,进而改善薄膜形貌、钝化缺陷并提升薄膜的稳定性;TBAI修饰的电池器件光电转换效率相较于PEAI修饰的器件提升了8.5%,同时器件的稳定性也得到了增强。该研究为开发适用于全无机CsPbI_(3)钙钛矿的新型表面修饰剂提供了指导和方向。 展开更多
关键词 表面修饰 四丁基碘化铵 苯乙基碘化铵 稳定性 cspbi_(3) 光电性能
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Proton‑Prompted Ligand Exchange to Achieve High‑Efficiency CsPbI_(3) Quantum Dot Light‑Emitting Diodes 被引量:1
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作者 Yanming Li Ming Deng +2 位作者 Xuanyu Zhang Lei Qian Chaoyu Xiang 《Nano-Micro Letters》 SCIE EI CAS CSCD 2024年第6期53-62,共10页
CsPbI_(3)perovskite quantum dots(QDs)are ideal materials for the next generation of red light-emitting diodes.However,the low phase stability of CsPbI_(3)QDs and long-chain insulating capping ligands hinder the improv... CsPbI_(3)perovskite quantum dots(QDs)are ideal materials for the next generation of red light-emitting diodes.However,the low phase stability of CsPbI_(3)QDs and long-chain insulating capping ligands hinder the improvement of device performance.Traditional in-situ ligand replacement and ligand exchange after synthesis were often difficult to control.Here,we proposed a new ligand exchange strategy using a proton-prompted insitu exchange of short 5-aminopentanoic acid ligands with long-chain oleic acid and oleylamine ligands to obtain stable small-size CsPbI_(3)QDs.This exchange strategy maintained the size and morphology of CsPbI_(3)QDs and improved the optical properties and the conductivity of CsPbI_(3)QDs films.As a result,high-efficiency red QD-based light-emitting diodes with an emission wavelength of 645 nm demonstrated a record maximum external quantum efficiency of 24.45%and an operational half-life of 10.79 h. 展开更多
关键词 cspbi_(3) perovskite quantum dots Light-emitting diodes Ligand exchange Proton-prompted in-situ exchange
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In Situ Iodide Passivation Toward Efficient CsPbI_(3) Perovskite Quantum Dot Solar Cells 被引量:1
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作者 Junwei Shi Ben Cohen‑Kleinstein +8 位作者 Xuliang Zhang Chenyu Zhao Yong Zhang Xufeng Ling Junjun Guo Doo‑Hyun Ko Baomin Xu Jianyu Yuan Wanli Ma 《Nano-Micro Letters》 SCIE EI CAS CSCD 2023年第10期28-39,共12页
All-inorganic CsPbI_3 quantum dots(QDs) have demonstrated promising potential in photovoltaic(PV) applications. However, these colloidal perovskites are vulnerable to the deterioration of surface trap states, leading ... All-inorganic CsPbI_3 quantum dots(QDs) have demonstrated promising potential in photovoltaic(PV) applications. However, these colloidal perovskites are vulnerable to the deterioration of surface trap states, leading to a degradation in efficiency and stability. To address these issues, a facile yet effective strategy of introducing hydroiodic acid(HI) into the synthesis procedure is established to achieve high-quality QDs and devices. Through an in-depth experimental analysis, the introduction of HI was found to convert PbI_2 into highly coordinated [PbI_m]~(2-m), enabling control of the nucleation numbers and growth kinetics. Combined optical and structural investigations illustrate that such a synthesis technique is beneficial for achieving enhanced crystallinity and a reduced density of crystallographic defects. Finally, the effect of HI is further reflected on the PV performance. The optimal device demonstrated a significantly improved power conversion efficiency of 15.72% along with enhanced storage stability. This technique illuminates a novel and simple methodology to regulate the formed species during synthesis, shedding light on ofurther understanding solar cell performance, and aiding the design of future novel synthesis protocols for high-performance optoelectronic devices. 展开更多
关键词 cspbi_(3)perovskite quantum dots In situ passivation Surface trap states perovskite solar cell
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Surface Treatment of Inorganic CsPbI_(3) Nanocrystals with Guanidinium Iodide for Efficient Perovskite Light-Emitting Diodes with High Brightness 被引量:2
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作者 Minh Tam Hoang Amandeep Singh Pannu +5 位作者 Yang Yang Sepideh Madani Paul Shaw Prashant Sonar Tuquabo Tesfamichael Hongxia Wang 《Nano-Micro Letters》 SCIE EI CAS CSCD 2022年第4期277-288,共12页
The remarkable evolution of metal halide perovskites in the past decade makes them promise for next-generation optoelectronic material.In particular,nanocrystals(NCs)of inorganic perovskites have demonstrated excellen... The remarkable evolution of metal halide perovskites in the past decade makes them promise for next-generation optoelectronic material.In particular,nanocrystals(NCs)of inorganic perovskites have demonstrated excellent performance for light-emitting and display applications.However,the presence of surface defects on the NCs negatively impacts their performance in devices.Herein,we report a compatible facial post-treatment of CsPbI_(3) nanocrystals using guanidinium iodide(GuI).It is found that the GuI treatment effectively passivated the halide vacancy defects on the surface of the NCs while offering effective surface protection and exciton confinement thanks to the beneficial contribution of iodide and guanidinium cation.As a consequence,the film of treated CsPbI_(3) nanocrystals exhibited significantly enhanced luminescence and charge transport properties,leading to high-performance light-emitting diode with maximum external quantum efficiency of 13.8%with high brightness(peak luminance of 7039 cd m^(−2) and a peak current density of 10.8 cd A^(−1)).The EQE is over threefold higher than performance of untreated device(EQE:3.8%).The operational half-lifetime of the treated devices also was significantly improved with T50 of 20 min(at current density of 25 mA cm^(−2)),outperforming the untreated devices(T50~6 min). 展开更多
关键词 cspbi_(3)perovskites NANOCRYSTALS Light-emitting diodes PHOTOLUMINESCENCE Surface passivation Guanidinium iodide
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Crystallization management of CsPbI_(2)Br perovskites by PbAc_(2)-incorporated twice spin-coating process for efficient and stable CsPbI_(2)Br perovskite solar cells
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作者 Yu Liu Kun Lang +6 位作者 Huifang Han Huijing Liu Yao Fu Pengchen Zou Yinhui Lyu Jia Xu Jianxi Yao 《Journal of Energy Chemistry》 SCIE EI CAS CSCD 2024年第10期419-428,I0008,共11页
CsPbI_(2)Br perovskite solar cell has been extensively studied due to its exceptional thermal stability and relatively stable perovskite phase structure.However,the presence of bromine leads to a rapid crystallization... CsPbI_(2)Br perovskite solar cell has been extensively studied due to its exceptional thermal stability and relatively stable perovskite phase structure.However,the presence of bromine leads to a rapid crystallization rate of CsPbI_(2)Br films,resulting in small grain size and high defect density.Additionally,CsPbI_(2)Br demonstrates poor light absorption due to its wide bandgap.Therefore,it is crucial to control the crystallization rate and increase the film thickness to reduce defect density,enhance light absorption,and improve photovoltaic performance.In this study,we utilized a PbAc_(2)-incorporated twice spincoating(PTS) process to address these issues.Initially,PbAc_(2) was added to the CsPbI_(2)Br precursor solution to form a CsPbI_(2)Br film,which was then coated with the CsPbI_(2)Br precursor solution to produce the PTS film,Ac^(-)can delay the perovskite crystallization,leading to the formation of thicker and denser CsPbI_(2)Br films.Moreover,lone-pair electrons of the oxygen atom provided by Ac^(-)formed coordination bonds with under-coordinated Pb~(2+) ions to fill halogen ion vacancies,thereby reducing the defect density.Ultimately,the PTS CsPbI_(2)Br device achieved a peak power conversion efficiency(PCE) of 16.19% and maintained 96.7% of its initial PCE over 1500 h at room temperature under 25% relative humidity without any encapsulation. 展开更多
关键词 cspbi_(2)Br Twice spin-coating process PbAc_(2) Crystallization management perovskite solar cells
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Synergistic stabilization of CsPbI_(3) inorganic perovskite via 1D capping and secondary growth 被引量:1
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作者 Jingya Mi Yuetian Chen +4 位作者 Xiaomin Liu Xingtao Wang Yanfeng Miao Yabing Qi Yixin Zhao 《Journal of Energy Chemistry》 SCIE EI CAS CSCD 2022年第5期387-392,共6页
Cesium lead iodide(CsPbI_(3)) perovskite has gained great attention in the photovoltaic(PV) community because of its unique optoelectronic properties, good chemical stability and appropriate bandgap for sunlight harve... Cesium lead iodide(CsPbI_(3)) perovskite has gained great attention in the photovoltaic(PV) community because of its unique optoelectronic properties, good chemical stability and appropriate bandgap for sunlight harvesting applications. However, compared to solar cells fabricated from organic-inorganic hybrid perovskites, the commercialization of devices based on all-inorganic CsPbI_(3) perovskites still faces many challenges regarding PV performance and long-term stability. In this work, we discovered that tetrabutylammonium bromide(TBABr) post-treatment to CsPbI_(3) perovskite films could achieve synergistic stabilization with both TBA+cation intercalation and Br-doping. Such TBA^(+) cation intercalation leads to onedimensional capping with TBAPb I3 perovskite formed in situ, while the Br-induced crystal secondary growth helps effectively passivate the defects of CsPbI_(3) perovskite, thus enhancing the stability. In addition, the incorporation of TBABr can improve energy-level alignment and reduce interfacial charge recombination loss for better device performance. Finally, the highly stable TBABr-treated CsPbI_(3)-based perovskite solar cells show reproducible photovoltaic performance with a champion efficiency up to 19.04%, while retaining 90% of the initial efficiency after 500 h storage without encapsulation. 展开更多
关键词 cspbi_(3)inorganic perovskite All-inorganic perovskite solar cell One-dimensional capping Synergistic stabilization
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Structure,ferroelectric,and enhanced fatigue properties of sol–gel-processed new Bi-based perovskite thin films of Bi(Cu_(1/2)Ti_(1/2))O_(3)–PbTiO_(3)
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作者 宋伟宾 席国强 +10 位作者 潘昭 刘锦 叶旭斌 刘哲宏 王潇 单鹏飞 张林兴 鲁年鹏 樊龙龙 秦晓梅 龙有文 《Chinese Physics B》 SCIE EI CAS CSCD 2024年第5期608-615,共8页
Bi-based perovskite ferroelectric thin films have wide applications in electronic devices due to their excellent ferroelectric properties.New Bi-based perovskite thin films Bi(Cu_(1/2)Ti_(1/2))O_(3)–PbTiO_(3)(BCT–PT... Bi-based perovskite ferroelectric thin films have wide applications in electronic devices due to their excellent ferroelectric properties.New Bi-based perovskite thin films Bi(Cu_(1/2)Ti_(1/2))O_(3)–PbTiO_(3)(BCT–PT) are deposited on Pt(111)/Ti/SiO_(2)/Si substrates in the present study by the traditional sol–gel method.Their structures and related ferroelectric and fatigue characteristics are studied in-depth.The BCT–PT thin films exhibit good crystallization within the phase-pure perovskite structure,besides,they have a predominant(100) orientation together with a dense and homogeneous microstructure.The remnant polarization(2P_(r)) values at 30 μC/cm^(2) and 16 μC/cm^(2) are observed in 0.1BCT–0.9PT and 0.2BCT–0.8PT thin films,respectively.More intriguingly,although the polarization values are not so high,0.2BCT–0.8PT thin films show outstanding polarization fatigue properties,with a high switchable polarization of 93.6% of the starting values after 10^(8) cycles,indicating promising applications in ferroelectric memories. 展开更多
关键词 FERROELECTRIC thin films perovskite PbTiO_(3)-BiMeO_(3)
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Modification of compact TiO_(2) layer by TiCl_(4)-TiCl_(3) mixture treatment and construction of high-efficiency carbon-based CsPbI_(2)Br perovskite solar cells 被引量:1
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作者 Wenran Wang Yu Lina +4 位作者 Guizhi Zhang Cuiting Kang Zhenxiao Pan Xinhua Zhong Huashang Rao 《Journal of Energy Chemistry》 SCIE EI CAS CSCD 2021年第12期442-451,I0010,共11页
In the construction of high performance planar perovskite solar cells(PSCs),the modification of compact TiO_(2) layer and engineering of perovskite/TiO_(2) interfaces are essential for efficient electron transfer and ... In the construction of high performance planar perovskite solar cells(PSCs),the modification of compact TiO_(2) layer and engineering of perovskite/TiO_(2) interfaces are essential for efficient electron transfer and retarded charge recombination loss.In this work,a facile and effective strategy is developed to modify the surface of compact TiO_(2) layer by TiCl_(4)-TiCl_(3) mixture treatment.Compared with conventional sole TiCl_(4),the TiCl_(4)-TiCl_(3) treatment takes the advantage of accelerated and controlled hydrolysis of TiCl_(3),therefore TiO_(2) with dominating anatase phase and moderate roughness is obtained to facilitate the growth of CsPbI_(2) Br perovskite layer with high quality.Furthermore,the oxidation-driven hydrolysis of TiCl_(3) component results in surface Cl doping that facilitates interfacial electron transfer with retarded recombination loss.The average power conversion efficiency(PCE) of carbon-based CsPbI_(2) Br planar PSCs based on TiCl_(4)-TiCl_(3) treatment increases to 14.18% from the intial 13.04% based on conventional sole TiCl_(4) treatment.The champion PSC exhibits a PCE of 14.46%(V_(oc)=1.28 V,J_(sc)=14.21 mA/cm^(2),and FF=0.794),which is one of the highest PCEs for carbon-based CsPbI_(2) Br PSCs. 展开更多
关键词 perovskite solar cells cspbi_(2)Br TiO_(2) TiCl_(3) PHOTOVOLTAIC
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Highly ordered crystallization of α-FAPbl_(3) films via homogeneous seeds for efficient perovskite solar cells
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作者 Guohui Luo Linfeng Zhang +11 位作者 Liyun Guo Xiuhong Geng Penghui Ren Yi Zhang Haihua Hu Xiaoping Wu Lingbo Xu Ping Lin Haiyan He Xuegong Yu Peng Wang Can Cui 《Journal of Energy Chemistry》 SCIE EI CAS CSCD 2024年第7期625-634,共10页
Formamidine lead triiodide(FAPbI_(3))perovskites have become the most promising photovoltaic materials for perovskite solar cells with record power conversion efficiency(PCE).However,random nucleation,phase transition... Formamidine lead triiodide(FAPbI_(3))perovskites have become the most promising photovoltaic materials for perovskite solar cells with record power conversion efficiency(PCE).However,random nucleation,phase transition,and lattice defects are still the key challenges limiting the quality of FAPbI_(3) films.Previous studies show that the introduction or adding of seeds in the precursor is effective to promote the nucleation and crystallization of perovskite films.Nevertheless,the seed-assisted approach focuses on heterogeneous seeds or hetero-composites,which inevitably induce a lattice-mismatch,the genera-tion of strain or defects,and the phase segregation in the perovskite films.Herein,we first demonstrate that high-quality perovskite films are controllably prepared using α-and δ-phases mixed FAPbI_(3) micro-crystal as the homogeneous seeds with the one-step antisolvent method.The partially dissolved seeds with suitable sizes improve the crystallinity of the perovskite flm with preferable orientation,improved carrier lifetime,and increased carrier mobility.More importantly,the α-phase-containing seeds promote the formation of α-phase FAPbI_(3) films,leading to the reduction of residual lattice strain and the suppres-sion of I-ion migration.Besides,the adding of dimethyl 2,6-pyridine dicarboxylate(DPD)into the pre-cursor further suppresses the generation of defects,contributing to the PCE of devices prepared in air ambient being significantly improved to 23.75%,among the highest PCEs for fully air-processed FAPbI_(3) solar cells.The unpackaged target devices possess a high stability,maintaining 80%of the initial PCE under simulated solar illumination exceeding 800 h. 展开更多
关键词 perovskite solar cells FAPbI_(3) Homogeneous seeds Strain Phase stability
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Inkjet-Printing Controlled Phase Evolution Boosts the Efficiency of Hole Transport Material Free and Carbon-Based CsPbBr_(3) Perovskite Solar Cells Exceeding 9%
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作者 Lihua Zhang Shi Chen +7 位作者 Jie Zeng Zhengyan Jiang Qian Ai Xianfu Zhang Bihua Hu Xingzhu Wang Shihe Yang Baomin Xu 《Energy & Environmental Materials》 SCIE EI CAS CSCD 2024年第2期209-220,共12页
Hole transport material free carbon-based all-inorganic CsPbBr_(3)perovskite solar cells(PSCs)are promising for commercialization due to its low-cost,high open-circuit voltage(V_(oc))and superior stability.Due to the ... Hole transport material free carbon-based all-inorganic CsPbBr_(3)perovskite solar cells(PSCs)are promising for commercialization due to its low-cost,high open-circuit voltage(V_(oc))and superior stability.Due to the different solubility of PbBr_(2)and CsBr in conventional solvents,CsPbBr_(3)films are mainly obtained by multi-step spin-coating through the phase evolution from PbBr_(2)to CsPb_(2)Br_(5)and then to CsPbBr_(3).The scalable fabrication of high-quality CsPbBr_(3)films has been rarely studied.Herein,an inkjet-printing method is developed to prepare high-quality CsPbBr_(3)films.The formation of long-range crystalline CsPb_(2)Br_(5)phase can effectively improve phase purity and promote regular crystal stacking of CsPbBr_(3).Consequently,the inkjet-printed CsPbBr_(3)C-PSCs realized PCEs up to 9.09%,8.59%and 7.81%with active areas of 0.09,0.25,and 1 cm^(2),respectively,demonstrating the upscaling potential of our fabrication method and devices.This high performance is mainly ascribed to the high purity,strong crystal orientation,reduced surface roughness and lower trap states density of the as-printed CsPbBr_(3)films.This work provides insights into the relationship between the phase evolution mechanisms and crystal growth dynamics of cesium lead bromide halide films. 展开更多
关键词 all-inorganic perovskite solar cells CsPbBr_(3) inkjet-printing phase evolution
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Comparison of Perovskite Systems Based on AFeO_(3)(A=Ce,La,Y)in CO_(2) Hydrogenation to CO
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作者 Anna N.Matveyeva Shamil O.Omarov 《Transactions of Tianjin University》 EI CAS 2024年第4期337-358,共22页
CO_(2) is the most cost-eff ective and abundant carbon resource,while the reverse water-gas reaction(rWGS)is one of the most eff ective methods of CO_(2) utilization.This work presents a comparative study of rWGS acti... CO_(2) is the most cost-eff ective and abundant carbon resource,while the reverse water-gas reaction(rWGS)is one of the most eff ective methods of CO_(2) utilization.This work presents a comparative study of rWGS activity for perovskite systems based on AFeO_(3)(where A=Ce,La,Y).These systems were synthesized by solution combustion synthesis(SCS)with diff erent ratios of fuel(glycine)and oxidizer(φ),diff erent amounts of NH 4 NO_(3),and the addition of alumina or silica as supports.Various techniques,including X-ray diff raction analysis,thermogravimetric analysis,Fourier transform infrared spectroscopy(FTIR),scanning electron microscopy,energy-dispersive X-ray spectroscopy,N 2-physisorption,H_(2) temper-ature-programmed reduction,temperature-programmed desorption of H_(2) and CO_(2),Raman spectroscopy,and in situ FTIR,were used to relate the physicochemical properties with the catalytic performance of the obtained composites.Each specifi c perovskite-containing system(either bulk or supported)has its own optimalφand NH_(4) NO_(3) amount to achieve the highest yield and dispersion of the perovskite phase.Among all synthesized systems,bulk SCS-derived La-Fe-O systems showed the highest resistance to reducing environments and the easiest hydrogen desorption,outperforming La-Fe-O produced by solgel combustion(SGC).CO_(2) conversion into CO at 600°C for bulk ferrite systems,depending on the A-cation type and preparation method,follows the order La(SGC)<Y<Ce<La(SCS).The diff erences in properties between La-Fe-O obtained by the SCS and SGC methods can be attributed to diff erent ratios of oxygen and lanthanum vacancy contributions,hydroxyl coverage,morphology,and free iron oxide presence.In situ FTIR data revealed that CO_(2) hydrogenation occurs through formates generated under reaction conditions on the bulk system based on La-Fe-O,obtained by the SCS method.γ-Al_(2)O_(3) improves the dispersion of CeFeO_(3) and LaFeO_(3) phases,the specifi c surface area,and the quantity of adsorbed H_(2) and CO_(2).This led to a signifi cant increase in CO_(2) conversion for supported CeFeO_(3) but not for the La-based system compared to bulk and SiO_(2)-supported perovskite catalysts.However,adding alumina increased the activity per mass for both Ce-and La-based perovskite systems,reducing the amount of rare-earth components in the catalyst and thereby lowering the cost without substantially compromising stability. 展开更多
关键词 perovskites LaFeO_(3) CeFeO_(3) YFeO_(3) Solution combustion synthesis CO_(2) hydrogenation Reverse water–gas reaction(rWGS)
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Ca_(2)MnO_(4)-layered perovskite modified by NaNO_(3)for chemical-looping oxidative dehydrogenation of ethane to ethylene
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作者 Weixiao Ding Kun Zhao +2 位作者 Shican Jiang Zhen Huang Fang He 《Chinese Journal of Chemical Engineering》 SCIE EI CAS CSCD 2024年第4期53-64,共12页
Chemical-looping oxidative dehydrogenation(CL-ODH)is a process designed for the conversion of alkanes into olefins through cyclic redox reactions,eliminating the need for gaseous O_(2).In this work,we investigated the... Chemical-looping oxidative dehydrogenation(CL-ODH)is a process designed for the conversion of alkanes into olefins through cyclic redox reactions,eliminating the need for gaseous O_(2).In this work,we investigated the use of Ca_(2)MnO_(4)-layered perovskites modified with NaNO_(3) dopants,serving as redox catalysts(also known as oxygen carriers),for the CL-ODH of ethane within a temperature range of 700-780℃.Our findings revealed that the incorporation of NaNO_(3) as a modifier significantly-nhanced the selectivity for-thylene generation from Ca_(2)MnO_(4).At 750℃and a gas hourly space velocity of 1300 h^(-1),we achieved an-thane conversion up to 68.17%,accompanied by a corresponding-thylene yield of 57.39%.X-ray photoelectron spectroscopy analysis unveiled that the doping NaNO_(3) onto Ca_(2)MnO_(4) not only played a role in reducing the oxidation state of Mn ions but also increased the lattice oxygen content of the redox catalyst.Furthermore,formation of NaNO_(3) shell on the surface of Ca_(2)MnO_(4) led to a reduction in the concentration of manganese sites and modulated the oxygen-releasing behavior in a step-wise manner.This modulation contributed significantly to the enhanced selectivity for ethylene of the NaNO_(3)-doped Ca_(2)MnO_(4) catalyst.These findings provide compelling evidence for the potential of Ca_(2)MnO_(4)-layered perovskites as promising redox catalysts in the context of CL-ODH reactions. 展开更多
关键词 Chemical-looping oxidative DEHYDROGENATION ETHANE ETHYLENE NaNO_(3)-doped Ca_(2)MnO_(4)redox catalyst Layered perovskites
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Treating CsPbI_(3) Perovskite with Pyrrolidinium Iodide to Improve the Performance of Perovskite Solar Cells
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作者 Qixian Zhang Yi Guo +3 位作者 Huicong Liu Weiping Li Liqun Zhu Haining Chen 《Journal of Renewable Materials》 EI 2023年第8期3193-3201,共9页
All-inorganic CsPbI_(3) perovskite has attracted wide attention due to its desirable optical bandgap(Eg:∼1.7 eV)as well as high chemical stability.Nevertheless,the photovoltaic performance of CsPbI_(3) perovskite sol... All-inorganic CsPbI_(3) perovskite has attracted wide attention due to its desirable optical bandgap(Eg:∼1.7 eV)as well as high chemical stability.Nevertheless,the photovoltaic performance of CsPbI_(3) perovskite solar cells(PSCs)was limited by severe nonradiative charge recombination due to high defect density at the grain boundary and surface of perovskitefilms.To address this issue,a pyrrolidinium iodide(PyI)molecule was introduced to modify the surface and grain boundary of CsPbI_(3) perovskitefilms to passivate defects,which improves the quality of CsPbI_(3) perovskitefilms as well as induces the generation of a quasi-2D Py_(2)CsPb_(2)I_(7) capping layer between per-ovskite layer and hole transport layer.Such quasi-2D Py_(2)CsPb_(2)I_(7) capping layer optimizes interface contact between CsPbI_(3) perovskite layer and hole transport layer and blocks the electron transfer from CsPbI_(3) perovskite photoactive layer to the hole transport layer.As a result,the performance of CsPbI_(3) PSCs is well improved to 17.87%for power conversion efficiency(PCE)with an ultra-high fill factor(FF)of 0.84.In addition,the PyI mole-cule modified CsPbI_(3) perovskite devices exhibit excellent stability,which remains its initial PCE almost unchanged after aging for 35 days under the dry air atmosphere(temperature:20℃–30℃,control relative humid-ity(RH):<10%). 展开更多
关键词 cspbi_(3) INORGANIC perovskite defect passivation pyrrolidinium iodide
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有机金属卤化物钙钛矿CH_(3)NH_(3)PbBr_(3)的各向异性Rashba效应
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作者 蔡锦鸿 余达明 周贤中 《原子与分子物理学报》 CAS 北大核心 2025年第6期153-158,共6页
本研究通过密度泛函理论结合全相对论赝势对钙钛矿CH_(3)NH_(3)PbBr_(3)中的各向异性Rashba效应进行了深入研究.发现,Pb-Br八面体的畸变引起了导带最小间隙的三重态在自旋轨道耦合(SOC)效应和晶格形变下的分裂,导致在不同方向上呈现出... 本研究通过密度泛函理论结合全相对论赝势对钙钛矿CH_(3)NH_(3)PbBr_(3)中的各向异性Rashba效应进行了深入研究.发现,Pb-Br八面体的畸变引起了导带最小间隙的三重态在自旋轨道耦合(SOC)效应和晶格形变下的分裂,导致在不同方向上呈现出强烈的各向异性.Rashba带分裂的最大系数可达2.0 eV?,并通过分析能级和电荷密度分布解释了Rashba效应的形成机制.这些研究结果有助于深化对CH_(3)NH_(3)PbBr_(3)性质的理解,同时为其在自旋电子学领域的潜在应用提供了理论基础. 展开更多
关键词 钙钛矿 CH_3NH_3PbBr_3 密度泛函理论 自旋轨道耦合
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反溶剂对CsPbBr_(3)太阳电池性能的影响 被引量:1
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作者 陈莹 李富强 《太阳能学报》 EI CAS CSCD 北大核心 2024年第4期122-126,共5页
分别在钙钛矿前驱体中添加一系列的反溶剂乙酸乙酯(EA)和乙腈(ACN),制备出不同形貌的CsPbBr_(3)薄膜,探究薄膜质量与太阳电池性能的内在联系。结果表明,在大气制备环境中,反溶剂有助于CsPbBr_(3)晶粒的生长,薄膜表面缺陷明显减少,太阳... 分别在钙钛矿前驱体中添加一系列的反溶剂乙酸乙酯(EA)和乙腈(ACN),制备出不同形貌的CsPbBr_(3)薄膜,探究薄膜质量与太阳电池性能的内在联系。结果表明,在大气制备环境中,反溶剂有助于CsPbBr_(3)晶粒的生长,薄膜表面缺陷明显减少,太阳电池各性能参数(短路电流密度、开路电压以及填充因子)均有所提升,尤其是添加乙腈(V(PbBr_(2)/DMF)∶V(ACN)=10∶1)后,光电转换效率(PCE)从3.16%提高到7.10%。 展开更多
关键词 钙钛矿太阳电池 太阳电池效率 薄膜制备 缺陷 反溶剂 CsPbBr_(3)
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基于FASnI_(3)的钙钛矿太阳电池仿真研究
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作者 甘永进 邱贵新 +2 位作者 曾昭祥 李玉霞 覃斌毅 《电源技术》 CAS 北大核心 2024年第10期2058-2065,共8页
为提高电池的效率、减少环境污染,提出一种结构为FTO/Zn(O_(0.3),S_(0.7))/FASnI_(3)/NiO/Au的无铅钙钛矿太阳电池。该电池以FASnI_(3)为光活性层,Zn(O_(0.3),S_(0.7))和NiO分别为电子传输层和空穴传输层,FTO和Au为接触电极。在太阳电... 为提高电池的效率、减少环境污染,提出一种结构为FTO/Zn(O_(0.3),S_(0.7))/FASnI_(3)/NiO/Au的无铅钙钛矿太阳电池。该电池以FASnI_(3)为光活性层,Zn(O_(0.3),S_(0.7))和NiO分别为电子传输层和空穴传输层,FTO和Au为接触电极。在太阳电池电容模拟器(SCAPS)中构建模型并设置材料参数,通过控制变量法进行参数优化。结果表明,当FASnI_(3)厚度为500 nm时,器件对光子的吸收较充分,输出最高的功率转换效率(PCE);随着FASnI_(3)缺陷态密度的升高,器件内部载流子复合中心增多,提高了载流子复合率,控制FASnI_(3)缺陷态密度不超过10^(14) cm^(-3)可确保电池输出性能较佳;当Zn(O_(0.3),S_(0.7))的厚度和电子亲和势优化为30 nm和3.5 eV时,载流子运输更为有效,电池输出最高的PCE;增大Zn(O_(0.3),S_(0.7))与FASnI_(3)界面缺陷态密度,导致光生载流子在界面更容易被捕获,控制Zn(O_(0.3),S_(0.7))与FASnI_(3)界面缺陷态密度不超过10^(13) cm^(-3)有利于提高电池性能。 展开更多
关键词 钙钛矿太阳电池 FASnI_(3) SCAPS仿真 活性层厚度 光电转换输出
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CsPbI_(3)/PVDF复合纤维基压电纳米发电机的构筑 被引量:1
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作者 陈慧颖 刘成 +1 位作者 杨涛 侯新梅 《辽宁科技大学学报》 CAS 2021年第1期43-49,共7页
无机铯铅卤素钙钛矿具有出色的光学和电子性能,已发展成为现代光电子纳米器件的新兴材料。本文配置溶有铯铅碘钙钛矿(CsPbI3)与聚偏氟乙烯(Polyvinylidene difluoride,PVDF)的前驱体溶液,采用静电纺丝方法,原位合成CsPbI3/PVDF复合纤维... 无机铯铅卤素钙钛矿具有出色的光学和电子性能,已发展成为现代光电子纳米器件的新兴材料。本文配置溶有铯铅碘钙钛矿(CsPbI3)与聚偏氟乙烯(Polyvinylidene difluoride,PVDF)的前驱体溶液,采用静电纺丝方法,原位合成CsPbI3/PVDF复合纤维。该纤维表面光滑,直径约为100 nm,内部均匀分布着平均直径约为20 nm的CsPbI3纳米晶粒。采用CsPbI3/PVDF复合纤维构筑的压电纳米发电机的开路电压(Voc)为9.18 V,短路电流密度为97.72 nA/cm2,输出电流Isc居于中等水平。研究表明,CsPbI3/PVDF复合纤维是构筑压电纳米发电机的可选材料,在机械能量收集和运动传感技术中具有广阔的应用前景。 展开更多
关键词 无机钙钛矿cspbi_(3) PVDF 复合材料 压电纳米发电机
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甲胺基金属卤化物MAPbX_(3)铁电半导体研究进展
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作者 南瑞华 刘腾 坚佳莹 《西安工业大学学报》 CAS 2024年第2期192-208,共17页
为了研究甲胺基金属卤化物MAPbX_(3)铁电半导体的铁电性对光伏性能的影响,文中梳理了近几年MAPbX_(3)的相关研究文献,分析了MAPbX_(3)晶体的光学吸收和载流子输运性能的影响因素,阐述了MAPbX_(3)铁电性的验证方法及铁电体中载流子的分... 为了研究甲胺基金属卤化物MAPbX_(3)铁电半导体的铁电性对光伏性能的影响,文中梳理了近几年MAPbX_(3)的相关研究文献,分析了MAPbX_(3)晶体的光学吸收和载流子输运性能的影响因素,阐述了MAPbX_(3)铁电性的验证方法及铁电体中载流子的分离机制,介绍了铁电半导体的应用,重点分析了MAPbX_(3)晶体结构方面的研究争议,讨论了MAPbX_(3)铁电性与铁弹性的关系,并对光伏器件的设计以及应用提出了新的研究思路。 展开更多
关键词 MAPbX_(3) 钙钛矿材料 光电性能 铁电性
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