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1.
锡二硫族化合物可以通过改变硫和硒的含量来连续调控三元合金材料的带隙、载流子浓度等物理化学性质,在电子和光电子器件应用上具有巨大的潜力。本文采用化学气相沉积(CVD)技术可控地制备了不同元素组分的SnSxSe2-x(x=0,0.2,0.5,0.8,1.0,1.2,1.5,1.8,2.0)单晶纳米片。采用扫描电子显微镜(SEM)、原子力显微镜(AFM)、能量色散X射线光谱(EDS)、透射电子显微镜(TEM)以及拉曼光谱等手段对SnSxSe2-x纳米片进行了综合表征。结果表明本方法成功实现了元素百分比可调的SnSxSe2-x单晶纳米片的可控制备。重点研究了依赖于元素百分比的SnSxSe2-x的拉曼特征谱,实验结果与基于密度泛函理论(DFT)的第一性原理计算得到的SnSxSe2-x的拉曼仿真谱高度吻合,理论计算结果较好地诠释了实验拉曼光谱发生变化的原因。本研究提供了一种元素百分比可调的三元SnSxSe2-x单晶纳米片的可控制备方法,同时对锡二硫族化合物的明确、无损识别提供了方案。  相似文献   
2.
Organic solar cells (OSCs) harvesting indoor light are highly promising for emerging technologies, such as internet of things. Herein, the photovoltaic performance of PTB7-Th:PC71BM solar cells constructed using “optimized (with 1,8-diiodooctane (DIO))” and “non-optimized (without DIO)” processing conditions are compared for indoor and outdoor applications. We find that in comparison to the “optimized” solar cell, the “non-optimized” solar cell is less efficient under simulated solar light illumination (100 mW cm−2, spectral range 350–1100 nm), owing to significant bimolecular charge carrier recombination losses. However, under simulated indoor illumination (3.28 mW cm−2, spectral range 400–700 nm), bimolecular recombination losses are effective suppressed, thus the power conversion efficiency of the solar cell without DIO was increased to 14.7 %, higher than that of the solar cell with DIO (14.2 %). These results suggest that the common strategy used to optimize the OSCs could be undesired for indoor OSCs. We demonstrate that the efforts for realizing the desired “morphology” of the active layer for the outdoor OSCs may be unnecessary for indoor OSCs, allowing us to realize high-efficiency indoor OSCs using a non-halogenated solvent.  相似文献   
3.
Dehydrogenation of an organic compound is the first and the most fundamental elementary reaction in many organic reactions. In ethanol oxidation reaction (EOR) to form CO2, there are a total of 46 pathways in C2HxO (x=1–6) species leading to the removal of all six hydrogen atoms in five C−H bonds and one O−H bond. To investigate the degree of dehydrogenation in EOR under operando conditions, we performed density function theory (DFT) calculations to study 28 dehydrogenation steps of C2HxO on Ir(100). An activation energy surface was then constructed and compared with that of the C−C bond cleavages to understand the importance of the degree of dehydrogenation in EOR. The results show that there are likely 28 dehydrogenations in EOR under fuel cell temperatures and the last two hydrogens in C2H2O are less likely cleaved. On the other hand, deep dehydrogenation including 45 dehydrogenations can occur under ethanol steam reforming conditions.  相似文献   
4.
One of the most common problems in wounds is delayed healing and complications such as infection. Therefore, the need for novel materials accelerates the healing of wounds especially abdominal wounds after surgery besides high efficiency and safety is mandatory. The rate of wound healing, anti-inflammatory and biocompatibility of Zn-Al LDH (Zn-Al layer double hydroxide) alone and loaded with Curcumin (Zn-Al LDH/Curcumin) was screened via in-vivo assays through intramuscular implantation in rat abdominal wall with intact peritoneum cavity. The implanted drugs were formed through Curcumin loaded into LDH of Zn-Al with drug release of 56.78 ± 1.51% within 24 h. The synthesized nanocomposite was characterized by (TGA/DTA) thermal analysis, (XRD) X-ray diffraction, (FESEM) Field emission scanning electron microscopy, (HRTEM) high resolution transmission electron microscope, energy dispersive X-ray (EDX) and low-temperature N2 adsorption, pore volume and average pore size distribution. The integrity of blood circulation, inflammatory signs, wound healing rate, capacity of tissue integration, antigenicity and composite biocompatibility, auto fluorescence ability of collagen bundles and the tensile strength of the muscle were assessed histopathologically after 7 and 30 days’ post-implantation. Excellent wound healing ability was achieved with shortest length between the wound gap edges and higher tensile strength of the muscle. Besides emit florescence very well followed by good healing and tensile muscles strength in Curcumin while very low strength with scar formation in Zn-Al LDH/Curcumin in both acute and chronic wound. No signs of inflammation in Curcumin & Zn-Al LDH. No vessels obstruction or bleeding observed in both Zn-Al LDH and Curcumin more than Zn-Al LDH/Curcumin and control which examined through candling. Good healing & infiltrated immune cells in same groups through histopathological examination. This work supports the anti-inflammatory, wound healing and biocompatibility of both LDH and Curcumin with living matter, increasing their biomedical applications in this era with safety and increasing efficacy with prolonged drug release.  相似文献   
5.
Supercapacitors (SCs) with high energy density and power density are a research hotspot. Herein, we report a flexible porous carbon membrane supercapacitor prepared by electrospinning polyacrylonitrile (PAN) with γ-cyclodextrin-MOF (γ-CD-MOF) and then carbonizing at 900 °C. BET results showed that the supercapacitor retained the skeleton of γ-CD, γ-CD-MOF and the pores formed by the spun-fibers, which were 0.73, 1.09 and 23–186 nm, respectively, showing a high specific surface area of 134.7 m2/g. The hierarchically porous structures ensure rapid charge transfer and ion diffusion, resulting in the PAN/γ-CD-MOF carbon electrode with a high capacity of 283.3 F/g. Moreover, the supercapacitor had a high energy density up to 17.5 Wh/kg and power density up to 6 kW/kg. Significantly, it showed excellent cycle stability with a capacitance retention of 97.5% after 6000 cycles. This work provides a supramolecular strategy to construct a flexible porous carbon membrane, which has potential for supercapacitor applications.  相似文献   
6.
自新冠肺炎(COVID-19)疫情爆发以来,国内外多家研究机构和企业都在加快推进新冠病毒(SARS-CoV-2)抗体药物的研发。药物多晶型限制了有效药物的研发进度。药物生产、存储和使用环境影响了药物的稳定性。红外光谱作为一种快速无损检测手段,可从振动光谱反映出药物结构、晶型甚至生产工艺上的差异大大提高了研发效率。首次以三种临床试验被认为治疗新冠肺炎有效药物:磷酸氯喹,利巴韦林和盐酸阿比多尔为例,利用傅里叶红外光谱仪测试得到它们在远红外(1~10 THz)和中红外(400~4 000 cm-1)波段的振动光谱。远红外光谱中,利巴韦林的特征峰位于:2.01,2.68,3.37,4.05,4.83,5.45,5.92,6.42和7.14 THz附近;磷酸氯喹的特征峰位于:1.26,1.87,2.37,3.06,3.78,5.09和6.06 THz附近;盐酸阿比多尔的特征峰位于:2.24,3.14,3.72,4.25和5.38 THz附近。结合密度函理论,选择B3LYP杂化泛函和6-311++G(d,p)基组,利用Crystal14和Gaussian16软件分析了光谱中所有特征峰对应的振动模式,实现了对振动光谱的精确指认。远红外波段,振动模式源自分子的集体振动。中红外波段,2 800 cm-1以下,振动模式主要源自基团的面内外弯曲和摇摆;2 800 cm-1以上,振动模式过渡为C—H,O—H和N—H键的面内伸缩。以考虑了周期性边界条件的晶体结构作为理论计算的初始构型,会让理论光谱与实验光谱更加吻合,尤其是在远红外波段和中红外400~1 000 cm-1的低频段。该研究对深入理解磷酸氯喹,利巴韦林和盐酸阿比多尔等抗病毒药物的药学特性,药物间相互作用,控制药物生产过程,指导药物存储和使用有重大意义。  相似文献   
7.
Lizhi Fang 《中国物理 B》2022,31(12):127802-127802
By using an improved Bridgman method, 0.3 mol% Tm$^{3+}/0.6$ mol% Tb$^{3+}/y$ mol% Eu$^{3+}$ ($y = 0$, 0.4, 0.6, 0.8) doped Na$_{5}$Y$_{9}$F$_{32}$ single crystals were prepared. The x-ray diffraction, excitation spectra, emission spectra and fluorescence decay curves were used to explore the crystal structure and optical performance of the obtained samples. When excited by 362 nm light, the cool white emission was realized by Na$_{5}$Y$_{9}$F$_{32}$ single crystal triply-doped with 0.3 mol% Tm$^{3+}/0.6$ mol% Tb$^{3+}/0.8$ mol% Eu$^{3+}$, in which the Commission Internationale de l'Eclairage (CIE) chromaticity coordinate was (0.2995, 0.3298) and the correlated color temperature (CCT) was 6586 K. The integrated normalized emission intensity of the tri-doped single crystal at 448 K could keep 62% of that at 298 K. The internal quantum yield (QY) was calculated to be $\sim 15.16$% by integrating spheres. These results suggested that the single crystals tri-doped with Tm$^{3+}$, Tb$^{3+}$ and Eu$^{3+}$ ions have a promising potential application for white light-emitting diodes (w-LEDs).  相似文献   
8.
本文在加权广义Schur补的基础上, 引入并研究了Hilbert空间上分块算子矩阵的加权Moore-Penrose逆和加权EP. 进一步, 给出了加权EP算子在算子方程中的一个应用.  相似文献   
9.
We give a conjecture on the lower bound of the ADM mass M by using the null energy condition. The conjecture includes a Penrose-like inequality $3M\geqslant \kappa { \mathcal A }/(4\pi )+\sqrt{{ \mathcal A }/4\pi }$ and the Penrose inequality $2M\geqslant \sqrt{{ \mathcal A }/4\pi }$ with ${ \mathcal A }$ the event horizon area and κ the surface gravity. Both the conjecture in the static spherically symmetric case and the Penrose inequality for a dynamical spacetime with spherical symmetry are proved by imposing the null energy condition. We then generalize the conjecture to a general dynamical spacetime. Our results raise a new challenge for the famous unsettled question in general relativity: in what general case can the null energy condition replace other energy conditions to ensure the Penrose inequality?  相似文献   
10.
延安是中国共产党领导革命的中心和战略总后方,是革命的红色摇篮。延安时期出版了大量具有历史、文化以及教育意义的红色文献,这些红色文献记载了中国共产党波澜壮阔的发展历程,也反映了延安时期不断发展的科技生产水平与独特的制浆造纸工艺,具有重要的研究价值。然而,延安时期出版的红色文献虽距今不到百年时间,但其保存现状不容乐观,普遍存在纸张老化、焦脆易碎等问题,大量文献急需科学检测与修复保护,以延长其保存寿命。目前,针对延安时期红色文献的检测研究仍存在较大空白。考虑到红色文献的珍贵性与特殊性,应当尽可能选择无损检测方法对其分析检测。基于衰减全反射-傅里叶变换红外光谱法(ATR-FTIR),以木素1 510 cm-1处特征峰与纤维素1 030 cm-1处特征峰的强度作为定量依据,建立了造纸原料与红色文献纸张中木素相对含量的无损检测方法。通过检测不同碱强度与碱浓度处理后的构皮、苦竹与杨木的木素含量,考察了制浆过程中碱处理条件对造纸原料脱木素程度的影响,同时体现了红外光谱法测定木素相对含量的普适性。以复旦大学图书馆藏的76册延安时期红色文献为研究对象,分析了红色文献的纸张木素含量与纸张pH值以及纸张氧化度的相互关系。结果表明,木素相对含量高于25%的红色文献,其纸张pH集中在3~4之间且纸张氧化度较高,文献整体保存状况堪忧;而木素相对含量低于25%的红色文献,其纸张氧化度与酸度较低,文献整体保存情况较好。以上结果验证了红外光谱无损检测法用于延安时期红色文献木素含量分析的可行性,并结合纸张氧化度与酸度数据提出了纸张木素含量的合适范围,为制浆造纸中植物原料的脱木素过程提供参考。拓展了红外光谱法在红色文献无损检测中的应用范围,以期为延安时期红色文献的修复与保护研究提供科学依据。  相似文献   
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