A new tantalate compound KSr 2Ta 3O 10 was synthesized by solid state reaction for the first time in the ternary system K 2O SrO Ta 2O 5, and its single crystals were prepared using flux method. The chemical compositi...A new tantalate compound KSr 2Ta 3O 10 was synthesized by solid state reaction for the first time in the ternary system K 2O SrO Ta 2O 5, and its single crystals were prepared using flux method. The chemical compositions, crystal structure, optical property, density and melting point of the new compound were characterized by EPMA, XRD, DTA and so on. KSr 2Ta 3O 10 crystallizes the orthorhombic system with unit cell parameters a= 0.784 4(1) nm, b =0.777 0(1) nm, c =3.012 7(1) nm and space group P 2 12 12 1, Z =8. The structure may be described as treble perovskite sheets [Sr 2Ta 3O 10 ] - interleaved with K +. Further, it was found that KSr 2Ta 3O 10 has intercalation phenomenon. Na +, Li +, H +, NH + 4 could exchange the interlayer cations K + of KSr 2Ta 3O 10 , and n hexylamine also could intercalate into the place between the layers of [Sr 2Ta 3O 10 ] -. [WT5HZ]展开更多
Since 1986,the donor-acceptor (D:A) heterojunction has been regarded a necessity for high-efficiency organic photovoltaics (OPVs),due to its unique advantage in compensating the intrinsic limitations of organic semico...Since 1986,the donor-acceptor (D:A) heterojunction has been regarded a necessity for high-efficiency organic photovoltaics (OPVs),due to its unique advantage in compensating the intrinsic limitations of organic semiconductors,such as high exciton binding energy and poor ambipolar charge mobility. While this adversely causes tremendous non-radiative charge recombination and instability issues,which currently become the most critical limits for commercialization of OPVs. Here,we present a concept-to-proof study on the potential of D:A heterojunction free OPV by taking advantage of recent progress of non-fullerene acceptors. First,we demonstrate that the “free carriers” can be spontaneously generated upon illumination in an NFA,i.e.,the 6TIC-4F single layer. Second,the 6TIC-4F layer also exhibits good ambipolar charge transporting property. These exceptional characteristics distinguish it from the traditional organic semiconductors,and relieve it from the reliance of D:A heterojunction to independently work as active layer. As a result,the subsequent OPV by simply sandwiching the 6TIC-4F layer between the cathode and anode yields a considerably high power conversion efficiency ~1%. Moreover,we find the D:A heterojunction free device exhibits two order of magnitude higher electroluminescence quantum efficiency and significantly reduced VOC loss by 0.16 eV compared to those of the D:A BHJ structure,validating its promise for higher efficiency in the future. Therefore,our work demonstrates the possibility of using D:A heterojunction-free device structure for high performance,that can potentially become the next game changer of OPV.展开更多
采用原位溶剂热法合成了2种混合有机阳离子杂化甲酸盐(CH(NH_(2))_(2))[RE(HCOO)_(4)](RE=Y、Er)。这2种材料是同构的(手性空间群C222_(1)),并具有有趣的类钙钛矿结构。进行了包括线性和非线性光学特性在内的光物理研究。(CH(NH_(2))_(2...采用原位溶剂热法合成了2种混合有机阳离子杂化甲酸盐(CH(NH_(2))_(2))[RE(HCOO)_(4)](RE=Y、Er)。这2种材料是同构的(手性空间群C222_(1)),并具有有趣的类钙钛矿结构。进行了包括线性和非线性光学特性在内的光物理研究。(CH(NH_(2))_(2))[Y(HCOO)_(4)]和(CH(NH_(2))_(2))[Er(HCOO)_(4)]分别表现出5.59和5.61 e V的宽光学带隙,对应于222和221 nm的紫外吸收边缘。粉末倍频测量表明,(CH(NH_(2))_(2))[Y(HCOO)_(4)]和(CH(NH_(2))_(2))[Er(HCOO)_(4)]的倍频效应分别是基准KH_(2)PO_(4)(KDP)的0.32和0.37倍。测量得到(CH(NH_(2))_(2))[Y(HCOO)_(4)]和(CH(NH_(2))_(2))[Er(HCOO)_(4)]的双折射率分别为0.013和0.015。第一性原理研究表明,2个π共轭的(CH(NH_(2))_(2))^(+)和HCOO^(-)基团是光学性质的主要贡献者。展开更多
A new niobate compound Ba4LaTiNb3O15 has been synthesized and characterized. Through Rietveld refinement of X-ray powder diffraction data, Ba4LaTiNb3O15 is identified as the A5B4O15 type cation-deficient perovskites w...A new niobate compound Ba4LaTiNb3O15 has been synthesized and characterized. Through Rietveld refinement of X-ray powder diffraction data, Ba4LaTiNb3O15 is identified as the A5B4O15 type cation-deficient perovskites with space group of P3m1(164) and lattice constants a=0.572 38(1) nm, c=1.169 48(1) nm, V=0.331 81(1) nm3, and Z=1. The crystal structure can be described as consisting of identical perovskite-like blocks, four corner-sharing (Ba,La)O6 octahedra thick, separated by layers of vacant octahedral. The (Ba,La)-O bond lengths range from 0.267 to 0.321 nm and the (Ti,Nb)-O bond lengths range from 0.175 to 0.213 nm. The Ba4LaTiNb3O15 ceramic has a high dielectric constant of 53.3, high quality factors (Q) 3 650 (at 6.402 5 GHz), and low temperature variation of resonant frequency (τf) +69.3 × 10-6 K-1.展开更多
The experimental and calculated data on the existence of complex oxides in solid state with the octahedral structures of four families,namely perovskites,Bi-containing layered perovskite-like ones,tetragonal tungsten ...The experimental and calculated data on the existence of complex oxides in solid state with the octahedral structures of four families,namely perovskites,Bi-containing layered perovskite-like ones,tetragonal tungsten bronzes and pyrochlores,and about their phase transitions are systematized and summarized on the basis of the quasi-elastic or geometric models of these structures.It has been established that similar existence areas and similar correlations between the interatomic bond strains in their structures,on the one hand,and the temperatures of their ferroelectric or antiferroelectric phase transitions,on the other hand,are observed for all of them,despite the differences in the compositions and structures of these oxides,but taking into account their similar parameters.展开更多
用柠檬酸络合法制备了多个系列的类钙钛石(A2BO4)结构的复合氧化物催化剂,系统地研究探讨了该类催化剂的晶体与光谱结构、缺陷结构、对NO和CO等小分子的吸附性能、对氧的吸脱性能及氧化还原性能和稳定性,同时考察了上述多个系列催化剂...用柠檬酸络合法制备了多个系列的类钙钛石(A2BO4)结构的复合氧化物催化剂,系统地研究探讨了该类催化剂的晶体与光谱结构、缺陷结构、对NO和CO等小分子的吸附性能、对氧的吸脱性能及氧化还原性能和稳定性,同时考察了上述多个系列催化剂对NO直接分解和CO还原NO反应的催化性能。发现Ni系A2BO4复合氧化物是NO直接分解的高活性催化体系,特别是LaSrNiO4-λ催化剂具有很高NO的分解活性,其活性高于文献报道Y Ba CuO/MgO的和Co系ABO3催化剂。同时发现LaSrCuO4-λ具有较高的CO还原NO催化性能。提出了在类钙钛石复合氧化物催化剂上NO分解和还原反应统一的氧化还原反应机制,并比较了两个反应的异同点,确认了氧空位在上述反应中的作用。并较深入的探讨了取代效应、过渡元素、稀土元素和结构效应对NO分解和CO还原NO反应的影响机制。本文分析总结了作者在类钙钛石(K2NiF4)结构复合氧化物的固态物化性质及对NOx消除反应的催化性能方面的基础性研究结果。展开更多
文摘A new tantalate compound KSr 2Ta 3O 10 was synthesized by solid state reaction for the first time in the ternary system K 2O SrO Ta 2O 5, and its single crystals were prepared using flux method. The chemical compositions, crystal structure, optical property, density and melting point of the new compound were characterized by EPMA, XRD, DTA and so on. KSr 2Ta 3O 10 crystallizes the orthorhombic system with unit cell parameters a= 0.784 4(1) nm, b =0.777 0(1) nm, c =3.012 7(1) nm and space group P 2 12 12 1, Z =8. The structure may be described as treble perovskite sheets [Sr 2Ta 3O 10 ] - interleaved with K +. Further, it was found that KSr 2Ta 3O 10 has intercalation phenomenon. Na +, Li +, H +, NH + 4 could exchange the interlayer cations K + of KSr 2Ta 3O 10 , and n hexylamine also could intercalate into the place between the layers of [Sr 2Ta 3O 10 ] -. [WT5HZ]
基金supported by the National Key Research and Development Program of China(No.2022YFB4200600)the National Natural Science Foundation of China(Nos.52173185 and 52127806)+1 种基金the Fundamental Research Funds for the Central Universities(Nos.226-2022-00133 and 226-2022-00209)L.Z.thanks the research start-up fund from Zhejiang University.
文摘Since 1986,the donor-acceptor (D:A) heterojunction has been regarded a necessity for high-efficiency organic photovoltaics (OPVs),due to its unique advantage in compensating the intrinsic limitations of organic semiconductors,such as high exciton binding energy and poor ambipolar charge mobility. While this adversely causes tremendous non-radiative charge recombination and instability issues,which currently become the most critical limits for commercialization of OPVs. Here,we present a concept-to-proof study on the potential of D:A heterojunction free OPV by taking advantage of recent progress of non-fullerene acceptors. First,we demonstrate that the “free carriers” can be spontaneously generated upon illumination in an NFA,i.e.,the 6TIC-4F single layer. Second,the 6TIC-4F layer also exhibits good ambipolar charge transporting property. These exceptional characteristics distinguish it from the traditional organic semiconductors,and relieve it from the reliance of D:A heterojunction to independently work as active layer. As a result,the subsequent OPV by simply sandwiching the 6TIC-4F layer between the cathode and anode yields a considerably high power conversion efficiency ~1%. Moreover,we find the D:A heterojunction free device exhibits two order of magnitude higher electroluminescence quantum efficiency and significantly reduced VOC loss by 0.16 eV compared to those of the D:A BHJ structure,validating its promise for higher efficiency in the future. Therefore,our work demonstrates the possibility of using D:A heterojunction-free device structure for high performance,that can potentially become the next game changer of OPV.
文摘采用原位溶剂热法合成了2种混合有机阳离子杂化甲酸盐(CH(NH_(2))_(2))[RE(HCOO)_(4)](RE=Y、Er)。这2种材料是同构的(手性空间群C222_(1)),并具有有趣的类钙钛矿结构。进行了包括线性和非线性光学特性在内的光物理研究。(CH(NH_(2))_(2))[Y(HCOO)_(4)]和(CH(NH_(2))_(2))[Er(HCOO)_(4)]分别表现出5.59和5.61 e V的宽光学带隙,对应于222和221 nm的紫外吸收边缘。粉末倍频测量表明,(CH(NH_(2))_(2))[Y(HCOO)_(4)]和(CH(NH_(2))_(2))[Er(HCOO)_(4)]的倍频效应分别是基准KH_(2)PO_(4)(KDP)的0.32和0.37倍。测量得到(CH(NH_(2))_(2))[Y(HCOO)_(4)]和(CH(NH_(2))_(2))[Er(HCOO)_(4)]的双折射率分别为0.013和0.015。第一性原理研究表明,2个π共轭的(CH(NH_(2))_(2))^(+)和HCOO^(-)基团是光学性质的主要贡献者。
文摘A new niobate compound Ba4LaTiNb3O15 has been synthesized and characterized. Through Rietveld refinement of X-ray powder diffraction data, Ba4LaTiNb3O15 is identified as the A5B4O15 type cation-deficient perovskites with space group of P3m1(164) and lattice constants a=0.572 38(1) nm, c=1.169 48(1) nm, V=0.331 81(1) nm3, and Z=1. The crystal structure can be described as consisting of identical perovskite-like blocks, four corner-sharing (Ba,La)O6 octahedra thick, separated by layers of vacant octahedral. The (Ba,La)-O bond lengths range from 0.267 to 0.321 nm and the (Ti,Nb)-O bond lengths range from 0.175 to 0.213 nm. The Ba4LaTiNb3O15 ceramic has a high dielectric constant of 53.3, high quality factors (Q) 3 650 (at 6.402 5 GHz), and low temperature variation of resonant frequency (τf) +69.3 × 10-6 K-1.
基金Research was financially supported by the Ministry of Science and Higher Education of the Russian Federation(State assignment in the field of scientific activity,Southern Federal University,2020).
文摘The experimental and calculated data on the existence of complex oxides in solid state with the octahedral structures of four families,namely perovskites,Bi-containing layered perovskite-like ones,tetragonal tungsten bronzes and pyrochlores,and about their phase transitions are systematized and summarized on the basis of the quasi-elastic or geometric models of these structures.It has been established that similar existence areas and similar correlations between the interatomic bond strains in their structures,on the one hand,and the temperatures of their ferroelectric or antiferroelectric phase transitions,on the other hand,are observed for all of them,despite the differences in the compositions and structures of these oxides,but taking into account their similar parameters.
文摘用柠檬酸络合法制备了多个系列的类钙钛石(A2BO4)结构的复合氧化物催化剂,系统地研究探讨了该类催化剂的晶体与光谱结构、缺陷结构、对NO和CO等小分子的吸附性能、对氧的吸脱性能及氧化还原性能和稳定性,同时考察了上述多个系列催化剂对NO直接分解和CO还原NO反应的催化性能。发现Ni系A2BO4复合氧化物是NO直接分解的高活性催化体系,特别是LaSrNiO4-λ催化剂具有很高NO的分解活性,其活性高于文献报道Y Ba CuO/MgO的和Co系ABO3催化剂。同时发现LaSrCuO4-λ具有较高的CO还原NO催化性能。提出了在类钙钛石复合氧化物催化剂上NO分解和还原反应统一的氧化还原反应机制,并比较了两个反应的异同点,确认了氧空位在上述反应中的作用。并较深入的探讨了取代效应、过渡元素、稀土元素和结构效应对NO分解和CO还原NO反应的影响机制。本文分析总结了作者在类钙钛石(K2NiF4)结构复合氧化物的固态物化性质及对NOx消除反应的催化性能方面的基础性研究结果。
