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Defence Technology · 2025 · IF 5.9

Interfacial stability effect of PDA@PVDF dual-coating on CL-20: Synergistically suppressed polymorphic transition and solubility

Hao Wang,Chenming Li,Enjie Zhang,Yapeng Ou,Xiaoxia Ma

Hexanitrohexaazaisowurtzitane (CL-20) is a high-energy explosive widely used in composite explosives and propellants, but its application is severely limited by thermally induced ε-to-γ polymorphic transition and high solubility in nitrate ester solvents. The transition reduces energy density and increasing sensitivity, and the solubility causes dissolution-recrystallization defects (e.g., voids, compositional inhomogeneities) during long-term storage. To address these issues while preserving its high energetic performance, this study developed a polydopamine@polyvinylidene fluoride (PDA@PVDF) dual-coating strategy, fabricating CL-20 composite particles with a core-shell structure. In-situ X-ray diffraction (XRD) results confirmed that the ε-to-γ phase transition temperature of CL-20 increased from 110 °C (pristine CL-20) to 140 °C. Meanwhile, the CL-20@PDA@9%PVDF sample exhibited the lowest solubility and the best solvent resistance, and the solubility of CL-20 in nitrate ester solvents was drastically reduced from 0.229 g/100 g to 0.026 g/100 g, an 88.6% decrease, effectively enhancing its structural and solvent resistance stability. For energetic performance, when mixed with aluminum powder at a 7:3 mass ratio, the CL-20@PDA@9%PVDF/Al composite achieved a combustion heat of 8275 J/g, 8.7% higher than that of the unmodified Al/CL-20 system (7611 J/g). Combustion pressure tests showed that although the modified system exhibited slightly lower initial peak pressure and pressure rise rate due to dilute CL-20 content from inert coatings, it presented a unique "delayed enhancement" effect, with pressure gradually surpassing and ultimately exceeding that of the unmodified system in the middle and late combustion stages, enabling more sustained high-pressure output. This work realizes the synergistic optimization of CL-20’s polymorphic/solvent stability and energetic performance, providing a feasible and scalable approach for the practical application of CL-20 in advanced energetic systems.

CAS / MDL: 1185-53-1 62-31-7
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Heliyon · 2023 ·Vol. 10 ·期 1 ·e23371 · IF 4

Amino acid promoted oxidation of atrazine by Fe3O4/persulfate.

Mingming Zheng,Yinghao Li,Menghua Cao,Yuxin Guo,Guohong Qiu,Shuxin Tu,Shuanglian Xiong,Dun Fang

In the present study, we demonstrated that the presence of cysteine could remarkably enhance the degradation of atrazine by Fe 3 O 4 /persulfate system. The results of electron paramagnetic resonance (EPR) spectra confirmed the combination of cysteine and Fe 3 O 4 exhibited much higher activity on activation of persulfate to generate more SO 4 •- and •OH than Fe 3 O 4 alone. At pH of 3.0, SO 4 •- and •OH contributed to about 58.2 % and 41.8 % of atrazine removal respectively, while •OH gradually dominated the oxidation of atrazine from neutral condition to alkaline condition. The co-existing Cl - and HCO 3 - could quench SO 4 •- , resulting in the inhibition of atrazine degradation. The presence of low natural organic matters (NOM) concentration (0-2 mg L -1 ) could enhance the atrazine removal, and high concentration (>5 mg L -1 ) of NOM restrained the atrazine degradation. During the Cysteine/Fe 3 O 4 /Persulfate process, cysteine served as a complexing reagent and reductant. Through acidolysis and complexation, Fe 3 O 4 could release dissolved and surface bound Fe 2+ , both of which contributed to the activation of persulfate together. Meanwhile, cysteine was not rapidly consumed due to a regeneration process, which was beneficial for maintaining Fe 2+ /Fe 3+ cycle and constantly accelerating the activation of persulfate for atrazine degradation. The reused Fe 3 O 4 and cysteine in the Cysteine/Fe 3 O 4 /Persulfate process exhibited high stability for the atrazine degradation after three cycles. The degradation pathway of atrazine included alkylic-oxidation, dealkylation, dechlorination-hydroxylation processes. The present study indicates the novel Cysteine/Fe 3 O 4 /Persulfate process might be a high potential for treatment of organic polluted water.

研究领域: 环境科学 · 化学工程 · 水处理 · 污染物降解
✓ 已验证 DOI PubMed 高影响因子
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JOURNAL OF MATERIALS SCIENCE · 2021 ·Vol. 56 ·期 12 ·7494-7507 · IF 4.22

Improving the Mn2+ emission and stability of CsPb(Cl/Br)3 nanocrystals by Ni2+ doping in ambient air

Zhang Rui,Yuan Yaoxin,Zhang Jianfeng,Liu Haiyun,Chen Gang,Li Kun,Hong MengQing,Zuo Wenbin,Wang Chunlan,Yang Wen,Qin Zhenxing

Mn-doped perovskite CsPb(Cl/Br) 3 nanocrystals (NCs) have been widely explored due to their unique dual-color emission characteristics, which could reduce the usage of toxic Pb and introduce the exciton emission in blue region and the stable Mn 2+ emission peak in orange-red region via energy transfer from exciton to Mn 2+ emission. Although doping high concentration Mn 2+ could increase the Mn 2+ emission, excess Mn 2+ ions would be expelled from the host perovskite lattice. Doping secondary metal Ni into the NCs as an efficient method is always used to improve the Mn 2+ emission. We adopted a one-pot halogen injection into Cs-precursor under ambient environment method to prepare (Mn, Ni): CsPbCl 3 and (Mn, Ni): CsPb(Cl/Br) 3 NCs, which introduces NiCl 2 in the Mn: CsPb(Cl/Br) 3 NCs to supply enough halide ions and to passivate defect states or traps in the perovskite NCs so as to enhance Mn 2+ emission. Density Functional Theory (DFT) calculations were also conducted to explain our experimental results, which revealed that Ni 2+ doping could eliminate the in-gap deep defects of the CsPb(Cl/Br) 3 nanocrystals. In addition, the passivated lattice defects help to improve the stability of the perovskite NCs, preventing from electron beam irradiation.

研究领域: 材料科学 · 光学
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Journal of Materials Chemistry A · 2020 ·Vol. 8 ·期 27 ·13610-13618 · IF 11.301

Pressure-driven chemical lock-in structure and optical properties in Sillen compounds PbBiO2X (X = Cl, Br, and I)

Qian Zhang,Xuqiang Liu,Nana Li,Bihan Wang,Quan Huang,Lin Wang,Dongzhou Zhang,Yonggang Wang,Wenge Yang

Sillen compounds with the general formula of PbBiO2X (X = Cl, Br, I) are frequently studied as photocatalysts, and have attracted widespread attention due to their degradation of organic contaminants and water oxidation under visible light irradiation. Among many photoelectric materials, the band gap has been reduced approaching to the optimum value by pressure (1.34 eV for photovoltaic materials according to the Shockley–Queisser limit), which is favorable to their photo-responsive applications. However, such enhanced properties are usually restored after the pressure is released. Here, by combining the pressure and chemical engineering tools, we discovered that the optimized structure and optical band gap of PbBiO2Br could be locked after compression–decompression treatment cycling by selecting appropriate elemental species. The pressure-induced strain retention in PbBiO2Br could be the cause of the structural and optical irreversible behavior. Moreover, the compression behavior and optical band gap under high pressure in the PbBiO2X system were studied systematically by in situ high pressure synchrotron X-ray diffraction, UV-vis absorption spectroscopy and resistivity experiments. Along with the enhanced photocurrent under compression, the PbBiO2X compounds under external pressure exhibited great potential for photocatalytic applications under solar light irradiation. In a suitable element category, the pressure-driven structural lock-in preserves its optical performance, opening up a new window for manipulating and filtrating better multifunctional materials.

研究领域: 材料科学 · 凝聚态物理 · 无机化学 · 光催化 · 功能材料
✓ 已验证 DOI 高影响因子
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Nanoscale Research Letters · 2016 ·Vol. 11 ·期 1 ·1-9 · IF 2.584

Enhanced performance of CH3NH3PbI3−x Cl x perovskite solar cells by CH3NH3I modification of TiO2-perovskite layer interface

Wang Wen,Zhang Zongbao,Cai Yangyang,Chen Jinshan,Wang Jianming,Huang Riyan,Lu Xubing,Gao Xingsen,Shui Lingling,Wu Sujuan,Liu Jun-Ming

In this work, perovskite solar cells (PSCs) with CH 3 NH 3 PbI 3- x Cl x as active layer and spiro-OMeTAD as hole-transport media have been fabricated by one-step method. The methylammonium iodide (CH 3 NH 3 I) solution with different concentrations is used to modify the interface between mesoporous TiO 2 (meso-TiO 2 ) film and CH 3 NH 3 PbI 3− x Cl x perovskite layer. Several techniques including X-ray diffraction, scanning electron microscopy, optical absorption, electrochemical impedance spectroscopy (EIS) and photoluminescence are used to investigate the effect of the interfacial modification. It is found that the interfacial modification by CH 3 NH 3 I enhance the crystallinity and increase the grain size of CH 3 NH 3 PbI 3− x Cl x layer, and improve the surface wetting properties of perovskite precursor on meso-TiO 2 film. The sunlight absorption and external quantum efficiency of PSCs in the visible region with wavelength less than 600 nm have been improved. The Nyquist plots obtained from the EIS suggest that the CH 3 NH 3 I modification can reduce the charge recombination rates. The photoluminescence measurement shows that the exciton dissociation in the modified devices is more effective than that in the control samples. The photovoltaic performance of the modified devices can be significantly improved with respect to the reference (control) devices. The CH 3 NH 3 I modified devices at the optimized concentration demonstrate the average power conversion efficiency of 12.27 % in comparison with the average efficiency of 9.68 % for the reference devices.

研究领域: 材料科学 · 光伏技术 · 纳米科技 · 表面科学 · 半导体物理 · 能源材料 · 器件物理
✓ 已验证 DOI 高影响因子
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DALTON TRANSACTIONS · 2022 ·Vol. 51 ·期 12 ·4728-4733 · IF 4.569

The synthesis and structure–property relation analysis of metal chalcohalide crystals Cs2InPS4X2 (X = Cl, Br) with mixed anions

Chunlan Tang,Wenhao Xing,Naizheng Wang,Jian Tang,Zheshuai Lin,Jieyun Wu,Wenlong Yin,Bin Kang

Inorganic metal chalcohalides are significant semiconductive materials for photovoltaics, photodetetion and infrared optics. Thus it is considerably rewarding to develop a new synthetic strategy to provide more degrees of freedom for atomic coordination to tune the optical and electronic properties of metal chalcohalides. In this work, the mixed-anion strategy is performed to synthesize two new metal chalcohalides Cs2InPS4X2 (X = Cl, Br) with mixed-anion structure by the reaction of InPS4 and CsX. Single-crystal X-ray diffraction analysis shows that they are isostructural and crystallize in the centrosymmetric space group P21/n, consisting of zero-dimensional structure [In2P2S8X4]4− (X = Cl, Br) built from tetrahedral [PS4]3− and octahedral [InS4X2]7− (X = Cl, Br) through edge-sharing, with Cs cations filling in intervening voids. The UV-vis-NIR diffuse reflectance spectroscopy measurement reveals that Cs2InPS4Cl2 and Cs2InPS4Br2 exhibit large optical bandgaps of 3.21 eV and 3.12 eV, respectively. The electronic structure calculations show that the bandgap mainly originates from the [InS4X2]7− (X = Cl, Br) mixed-anion groups. First-principles calculations indicate that the birefringence of Cs2InPS4Cl2 and Cs2InPS4Br2 is ∼0.08 and ∼0.05 at 2090 nm, respectively. Furthermore, thermal analysis reveals that the Cs2InPS4X2 (X = Cl, Br) are thermostable up to 400 °C. This discovery enriches the structural diversity of inorganic chalcohalides and provides an insight for the exploration of new semiconductive materials.

研究领域: 无机化学 · 材料科学 · 半导体物理 · 晶体工程 · 红外光学
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International Journal of Electrochemical Science · 2023 ·Vol. 14 ·期 1 ·75-90 · IF 1.5

Corrosion Inhibition Effect of Molybdate on Fine-Grain High- Strength Reinforcement in Simulated Concrete Pore Solutions Containing Cl–

Bilan Lin,Yuye Xu

To improve the corrosion resistance of fine-grain high-strength (FGHS) reinforcement, molybdate was investigated as a inhibitor. The influence of molybdate on the corrosion behavior of FGHS reinforcement in simulated concrete pore (SCP) solutions containing 1.0% or 3.5% NaCl was evaluated using polarization, electrochemical impedance spectroscopy, and Mott-Schottky curves. The corrosion products were analyzed using scanning electron microscopy and energy-dispersive X-ray spectroscopy. The results revealed that upon increasing the molybdate content, the corrosion current density ( i corr ) and donor density initially rapidly decreased and then slightly increased, while the corrosion protection efficiency and impedance first rapidly increased and then slightly decreased. The optimum molybdate was 1.0 g/L. The i corr of the former (0.058 μA cm -2 ) was considerably less than that of the latter (0.250 μA cm -2 ). The Mott-Schottky curves for the former were continuous, whereas some of those for the latter were discontinuous owing to the depletion of a less Fe 3+ in the corrosion product. Almost no pits on the reinforcement were observed for the former, whereas a few pits were still observed for the latter. Molybdate exhibited good corrosion inhibition of FGHS reinforcement at low chloride concentrations, although other or composite inhibitors should be considered for high chloride concentrations.

研究领域: 材料科学 · 腐蚀工程 · 土木工程 · 电化学
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ACS Nano · 2015 · IF 12.881

Brightly Luminescent and Color-Tunable Colloidal CH3NH3PbX3 (X = Br, I, Cl) Quantum Dots: Potential Alternatives for Display Technology

Feng Zhang,Haizheng Zhong,Cheng Chen,Xian-gang Wu,Xiangmin Hu,Hailong Huang,Junbo Han,Bingsuo Zou,Yuping Dong

Organometal halide perovskites are inexpensive materials with desirable characteristics of color-tunable and narrow-band emissions for lighting and display technology, but they suffer from low photoluminescence quantum yields at low excitation fluencies. Here we developed a ligand-assisted reprecipitation strategy to fabricate brightly luminescent and color-tunable colloidal CH3NH3PbX3 (X = Br, I, Cl) quantum dots with absolute quantum yield up to 70% at room temperature and low excitation fluencies. To illustrate the photoluminescence enhancements in these quantum dots, we conducted comprehensive composition and surface characterizations and determined the time- and temperature-dependent photoluminescence spectra. Comparisons between small-sized CH3NH3PbBr3 quantum dots (average diameter 3.3 nm) and corresponding micrometer-sized bulk particles (2–8 μm) suggest that the intense increased photoluminescence quantum yield originates from the increase of exciton binding energy due to size reduction as well as proper chemical passivations of the Br-rich surface. We further demonstrated wide-color gamut white-light-emitting diodes using green emissive CH3NH3PbBr3 quantum dots and red emissive K2SiF6:Mn4+ as color converters, providing enhanced color quality for display technology. Moreover, colloidal CH3NH3PbX3 quantum dots are expected to exhibit interesting nanoscale excitonic properties and also have other potential applications in lasers, electroluminescence devices, and optical sensors.

研究领域: 材料科学 · 纳米技术 · 光电子学 · 显示技术 · 光子学
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CHEMICAL RESEARCH IN CHINESE UNIVERSITIES · 2023 ·Vol. 39 ·期 4 ·654-659 · IF 3.1

Tuning Photodetection Band of MAPbX3(X=Cl/Br/I) Perovskite Single Crystals by Sub-nano Carbon Dot Doping

Zhu Xia,An Jiakun,Chen Gaoyu,Xing Chenyu,Bao Jianchun,Xu Xiangxing

Perovskite single crystals are prominent semiconductor materials due to their high carrier mobility, long carrier diffusion length, and large absorption coefficient. They can be used as optoelectronic functional materials for narrowband or broadband photodetectors. In this report, the photodetection band tunability was achieved by doping MAPbX 3 (MA=methylammonium, X=Cl/Br/I) perovskite single crystals with sub-nano carbon dots (MAPbX 3 -C). The sub-nano size and good dispersibility of the carbon dots ensured controllable doping. The absorption of the sub-nano carbon dots and trap states in the MAPbX 3 -C single crystals resulted in the special responsivity spectrum features.

研究领域: 材料科学 · 光电子学 · 半导体物理 · 纳米技术 · 光子学
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FirePhysChem · 2026 · IF 3.6

3D Printing and Performance Study of CL-20-based Composite Energetic Materials with PVA/PAA/M-PTW Networks

Handong Shi,Shijiao Li,Chuanhao Xu,Kai Han,Fan Liao,Yanpeng Lv,Guoqiang He,Wenxuan Liang,Chongwei An

This work presents a molecular-to-structural strategy for fabricating high-performance CL-20-based composite energetic materials using direct ink writing (DIW). A poly(vinyl alcohol)/poly(acrylic acid)/modified potassium titanate whisker (PVA/PAA/ M-PTW) interpenetrating polymer network (IPN) was designed to simultaneously enhance mechanical strength and reduce mechanical sensitivity. The hydrogen bonding–covalent crosslinking–filler reinforcement mechanism ensured uniform dispersion of CL-20 crystals and strong interfacial adhesion within the polymer matrix. Surface modification of PTW with 5 wt% KH-550 improved compatibility with the IPN, yielding printed structures with excellent form accuracy and adhesion to aluminum substrates (0.961 MPa). The optimized composite exhibited high compressive strength (16.77 MPa) and reduced impact and friction sensitivities compared with ε-CL-20 and submicron CL-20 samples. It achieved stable detonation wave transmission within a 90°-160° corner range in a 1.2 × 1.2mm charge slot, with the critical detonation size reaching 0.3m × 0.3mm. The measured detonation velocity of 7267.9m/s (83.2% of theoretical). These results demonstrate that the DIW-based PVA/PAA/M-PTW system enables the precise construction of high-strength, low-sensitivity energetic composites with reliable detonation performance, providing a promising pathway for advanced micro-scale energetic devices.

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SEPARATION AND PURIFICATION TECHNOLOGY · 2026 · IF 9.1

In situ long-acting ammonium removal from groundwater using a modified sustained-release candle-constructed SO4•-–Cl- system

Kaijie Pei,Hang Lyu,Ai-Bo Jia,Rong Zhong,Chuping Chang,Xiaosi Su

Ammonium in groundwater hampers sustainable water use, calling for efficient, stable in-situ remediation technologies. In this study, we design a novel coated sustained-release candle (CSRC) that contains peroxymonosulfate (PMS) and chloride ions (Cl − ). The aim is to construct an in situ long-acting SO 4 • − –Cl − oxidation system for groundwater ammonium removal. The outer coating effectively addressed the issue of “burst release” of paraffin-based sustained-release materials during the initial release stage. It also prolonged the effective release period and guaranteed the synchronous PMS and Cl − release. Systematic static release experiments revealed the critical roles of the CSRC diameter and reagent-to-paraffin mass ratio in regulating the release profiles. Column experiments demonstrated that CSRC deployment within an injection well significantly enhanced the reagent release compared to direct embedding. In addition, the groundwater flow rate exerted no influence on the CSRC release. The long-term operation confirmed the sustained generation of Cl•/ClO• and effective ammonium removal along the flow path. Moreover, three-dimensional tank experiments under varying hydraulic gradients and screen lengths showed that increases in the hydrodynamic conditions and well-screen length markedly improved the radial penetration and vertical dispersion of reagents in the aquifer and enabled the effective ammonium removal for up to 56 days. Collectively, this work presents a feasible and engineered strategy by adjusting the reagents ratio, diameter, and CSRC length that achieves the stable, long-term in-situ chemical oxidation of ammonium in groundwater. This work offers theoretical insights and practical guidance for applying sustained-release material-based remediation systems in the field.

✓ 已验证 DOI 高影响因子
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Materials Science and Engineering B-Advanced Functional Solid-State Materials · 2021 · IF 4.051

Highly efficient Mn-doped CsPb(Br/Cl)3 mixed-halide perovskite via a simple large-scale synthesis method

Zhihao Chen,Haiyang He,Zhuoqi Wen,Zhongjie Cui,Shiliang Mei,Dan Yang,Xian Wei,Wanlu Zhang,Fengxian Xie,Bobo Yang,Ruiqian Guo

Broadband emission Mn 2+ doped lead halide perovskites are deemed as promising phosphor materials for solid state white light-emitting-diodes (WLEDs). Herein, we report a facile gram-scale synthesis of Mn-doped CsPb(Br/Cl) 3 phosphors by doping MnCl 2 into CsPbBr 3 perovskite nanocrystals at room temperature. The obtained phosphors present dual-color emission with blue emission at 463 nm and red emission at 602 nm. Increasing MnCl 2 doping amount can enhance the red emission while more 3-Aminopropyltrimethoxysilane (APTMS) ligands can repress Mn related impurity and provide high stability. Further, two kinds of WLEDs (monocomponnet and two-component) are demonstrated. The monocomponent WLED exhibits warm white light under various driving currents (30 mA–150 mA), and the two-component WLED shows good chromatic performance close to ideal white light (0.33, 0.33), demonstrating their potential applications in WLED devices.

研究领域: 材料科学 · 光学工程
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