Explosive Agents

炸药
  • 文章类型: Journal Article
    分析了长期弹药污染对微生态特性的影响,制定了微生物修复策略。具体来说,酶系统的反应,N/O稳定同位素,离子网络,和微生物群落结构/功能水平在长期(50年)弹药污染的水/沉积物从污染地点进行了分析,并选择了一种能够有效降解三硝基甲苯(TNT)同时耐受许多重金属的复合细菌剂来修复弹药污染的土壤。水/沉积物的基本物理和化学性质(pH(最高:0.57-0.64),硝酸盐(上升:1.31-4.28倍),亚硝酸盐(上升:1.51-5.03倍),和铵(上升:7.06-70.93倍)变化明显,N和O(硝酸盐氮)的稳定同位素比的显着差异证实了长期暴露于污染的本地微生物对TNT的降解能力。重金属,如Pb,Zn,Cu,Cd,Cs,Sb,在弹药污染的场所有协同毒性作用,并显著降低了核心污染区的微生物多样性和丰富度。然而,长期暴露在边缘污染区诱导微生物利用TNT作为碳源和氮源进行生命活动和生长发育。拟杆菌微生物群受到弹药污染的显著抑制,而微生物如变形杆菌,酸杆菌,和Com科通过调节其发育和应激反应逐渐适应这种环境胁迫。弹药污染显著影响微生态遗传网络中的DNA复制和基因调控,增加了人类健康风险。Mg和K显著参与了微生物运输的内在机制,富集,和TNT的代谢。筛选了9株利用TNT的微生物,它们具有有效的TNT降解和对典型重金属的耐受性(铜,锌和铅)在受污染的地方发现,为有效修复弹药污染土壤而制备的复合细菌剂显著改善了土壤生态环境。
    The effects of long-term ammunition pollution on microecological characteristics were analyzed to formulate microbial remediation strategies. Specifically, the response of enzyme systems, N/O stable isotopes, ion networks, and microbial community structure/function levels were analyzed in long-term (50 years) ammunition-contaminated water/sediments from a contamination site, and a compound bacterial agent capable of efficiently degrading trinitrotoluene (TNT) while tolerating many heavy metals was selected to remediate the ammunition-contaminated soil. The basic physical and chemical properties of the water/sediment (pH (up: 0.57-0.64), nitrate (up: 1.31-4.28 times), nitrite (up: 1.51-5.03 times), and ammonium (up: 7.06-70.93 times)) were changed significantly, and the significant differences in stable isotope ratios of N and O (nitrate nitrogen) confirmed the degradability of TNT by indigenous microorganisms exposed to long-term pollution. Heavy metals, such as Pb, Zn, Cu, Cd, Cs, and Sb, have synergistic toxic effects in ammunition-contaminated sites, and significantly decreased the microbial diversity and richness in the core pollution area. However, long-term exposure in the edge pollution area induced microorganisms to use TNT as a carbon and nitrogen sources for life activities and growth and development. The Bacteroidales microbial group was significantly inhibited by ammunition contamination, whereas microorganisms such as Proteobacteria, Acidobacteriota, and Comamonadaceae gradually adapted to this environmental stress by regulating their development and stress responses. Ammunition pollution significantly affected DNA replication and gene regulation in the microecological genetic networks and increased the risk to human health. Mg and K were significantly involved in the internal mechanism of microbial transport, enrichment, and metabolism of TNT. Nine strains of TNT-utilizing microbes were screened for efficient TNT degradation and tolerance to typical heavy metals (copper, zinc and lead) found in contaminated sites, and a compound bacterial agent prepared for effective repair of ammunition-contaminated soil significantly improved the soil ecological environment.
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  • 文章类型: Journal Article
    在这项工作中,使用COMSOLMultiphysics探索了硝酸铵和硫化矿石之间的放热反应特征。这种反应会导致硫化物矿的爆破孔内的温度升高,并可能引起炸药的过早爆炸。最初,进行模拟以观察炸药装载前后爆破孔中的温度变化。然后,评估了炮孔直径和初始温度对热环境的影响。随后的分析集中在流体场的动力学,检查流速变化和反应产生的特征气体的浓度。此外,评价了炮孔直径对这些参数的影响。结果表明,炮孔温度与其直径和初始温度呈正相关。当爆破孔的直径为120毫米和165毫米时,观察到流量的显著变化,呈先迅速增加后迅速下降的趋势。总是发现NH3的产量大于其他两种气体的产量。至于NO和SO2,其产生的特征在于大约1:2的比例。数值模拟结果可为硫化矿炮孔自爆提供重要的理论指导。
    In this work, the characteristics of the exothermic reaction between ammonium nitrate and sulfide ores were explored using COMSOL Multiphysics. This reaction can cause an increase in temperature within the blast holes of sulfide mines and can potentially induce premature explosions of the explosives. Initially, simulations were conducted to observe temperature variations in blast holes before and after the loading of explosives. Then, the impact of blast hole diameter and initial temperature on the thermal environment was assessed. Subsequent analysis focused on the fluid field\'s dynamics, examining flow rate changes and the concentration of signature gases produced by the reaction. Additionally, the influence of blast hole diameter on these parameters was evaluated. The results show that the blast hole temperature is positively related to its diameter and initial temperature. When the diameter of the blast hole is 120 mm and 165 mm, a significant change in flow rate is observed, with a trend of being rapidly increased and then rapidly decreased. The production of NH3 is always found to be greater than that of the other two gases. As for NO and SO2, their production is characterized by an approximate ratio of 1:2. The numerical simulation results can provide important theoretical guidance for the spontaneous detonation of blast hole in sulfide mines.
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  • 文章类型: Journal Article
    面对不断上升的恐怖主义威胁,环境和健康风险,实现对基于过氧化物的爆炸物(PEs)的灵敏和选择性检测已成为全球关注的焦点。在这项研究中,基于苯并(H2O2识别元素)和4,4-二氟-4-硼-3a的开启荧光探针(BOD),4a-二氮杂-s-茚并苯(BODIPY)衍生物(荧光团)被开发用于灵敏和特异性地检测过氧化氢(H2O2)。由于分子内供体激发的光致电子转移(d-PET)效应,合成的BOD具有非常弱的荧光;它可以发出强烈的荧光,因为H2O2选择性氧化苯偶酰部分并释放游离的BODIPY荧光团(BOD-COOH)。因此,拟议的BOD在线性检测中检测H2O2的范围为25至125µM,检测限为4.41µM。同时,拟议的BOD对H2O2具有良好的选择性,不受其他常见活性氧(ROS)和爆炸性残留物离子的影响。此外,添加H2O2后,在吸收光谱中观察到从508到498nm的蓝移。更重要的是,BOD成功地应用于快速检测H2O2蒸气,具有良好的灵敏度(低至7ppb),在公共安全中具有巨大的实际应用潜力,法医分析和环境监测。
    Faced with rising threats of terrorism, environmental and health risks, achieving sensitive and selective detection of peroxide-based explosives (PEs) has become a global focus. In this study, a turn-on fluorescent probe (BOD) based on benzil (H2O2-recognition element) and 4,4-difluoro-4-bora-3a,4a-diaza-s-indacene (BODIPY) derivative (fluorophore) was developed to sensitively and specifically detect hydrogen peroxide (H2O2). The synthesized BOD had a very weak fluorescence due to intramolecular donor-excited photo-induced electron transfer (d-PET) effect; however, it could emit a strong fluorescence since H2O2 selectively oxidized the benzil moiety and released free BODIPY fluorophore (BOD-COOH). As a result, the proposed BOD detected H2O2 in linear detection ranged from 25 to 125 µM with a detection limit of 4.41 µM. Meanwhile, the proposed BOD showed good selectivity toward H2O2, which is not affected by other common reactive oxygen species (ROS) and ions from explosive residues. In addition, a blue shift from 508 to 498 nm was observed in the absorption spectra upon addition of H2O2. More importantly, the BOD was successfully applied for rapid detection of H2O2 vapor with good sensitivity (down to 7 ppb), which holds great potential for practical use in public safety, forensic analysis and environmental monitoring.
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  • 文章类型: Journal Article
    冲突区域中的残留爆炸物对人类安全和环境造成了不可逆转的损害。全细胞生物传感器可以检测到埋藏炸药的残留物,如2,4-二硝基甲苯(DNT),炸药中的一种稳定且高挥发性的化合物。然而,所有报道的全细胞生物传感器都利用荧光或发光作为生物标记,在真正的雷区很难发现它们.这里,我们提出了一个基于番茄红素的全细胞生物传感器在大肠杆菌输出可见信号响应DNT,这可以帮助视觉检测埋藏的爆炸物。构建全细胞生物传感器,DNT应答启动子YQJF用作传感元件,番茄红素合成基因盒crtEBI作为报告元件。然后,番茄红素生产的代谢通量增强,以提高全细胞生物传感器的输出信号,和终止子被用来减少背景干扰。优化的生物传感器LSZ05可以感知至少1mg/L的DNT。证实了生物传感器在不同环境因素下的DNT特异性和鲁棒性能。我们的结果表明,将生物传感器转化为冻干粉是一种有效的储存方法。生物传感器LSZ05可以有效检测两种土壤样品中的DNT。基于番茄红素的全细胞生物传感器也可用于视觉检测重金属。我们的发现为目视探测雷区埋藏的爆炸物奠定了基础,这是对所报道的生物传感器的宝贵补充。用于优化基于番茄红素的全细胞生物传感器的方法,包括改善输出信号和减少背景干扰,相当有效。
    Residual explosives in conflicting zones have caused irreversible damage to human safety and the environment. Whole-cell biosensors can to detect remnants of buried explosives, such as 2,4-dinitrotoluene (DNT), a stable and highly volatile compound in explosives. However, all the reported whole-cell biosensors utilize fluorescence or luminescence as the biological markers, making their detection difficult in real minefields. Here, we presented a lycopene-based whole-cell biosensor in Escherichia coli to output visible signals in response to DNT, which can help in the visual detection of buried explosives. To construct the whole-cell biosensor, the DNT-responsive promoter yqjF was used as the sensing element, and the lycopene synthetic gene cassette crtEBI was served as the reporting element. Then, the metabolic flux for lycopene production was enhanced to improve the output signal of the whole-cell biosensor, and a terminator was utilized to reduce the background interference. The optimized biosensor LSZ05 could perceive at least 1 mg/L DNT. The DNT-specificity and robust performance of the biosensor under different environmental factors were confirmed. Our results showed that converting the biosensor into a lyophilized powder was an effective storage method. The biosensor LSZ05 could effectively detect DNT in two kinds of soil samples. The lycopene-based whole-cell biosensor could also be used to visually detect heavy metals. Our findings laid the foundation for visually detecting buried explosives in minefields, which was a valuable supplement to the reported biosensors. The methods used for optimizing the lycopene-based whole-cell biosensor, including the improvement of the output signal and reduction of background interference, were quite effective.
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  • 文章类型: Journal Article
    由于埋藏的地雷造成的环境污染和潜在的人道主义风险,探测未爆炸的地雷至关重要。因此,这项研究的重点是开发一种能够安全有效地检测爆炸物的生物传感器系统。设计了一种新型的基于转录因子的大肠杆菌生物传感器,用于检测1,3-二硝基苯(1,3-DNB)。来自恶臭假单胞菌的MexT转录因子(P。putida)被确定为该生物传感器中的基本传感元件。研究发现,MexT通过与PP_2827之间的双向启动子区结合,并在1,3-DNB条件下显著增强下游基因的表达。通过采用mexT基因和启动子的不同组合开发了基于MexT的1,3-DNB生物传感器。优化的生物传感器显示出足够的灵敏度,可检测液体溶液中0.1μg/mL的1,3-DNB,具有令人满意的特异性和长期稳定性。随后,将基于MexT的生物传感器集成到检测装置中,以模拟爆炸物的现场勘探。该系统对沙子中的1,3-DNB的检测灵敏度为0.5mg/kg,并实现了现场和大规模区域的检测以及土壤下埋藏的1,3-DNB的位置。这项研究提供了一种新型的基于转录因子的细菌生物传感器和一个完整的系统(中国地球眼,CEE)用于1,3-DNB的灵敏检测。这种生物传感器系统的良好性能可以促进准确、现场,以及在真正的广泛雷区中对炸药的高效勘探。此外,这种1,3-DNB生物传感器可以与之前报道的2,4-DNT生物传感器互补,展示其在军事场合的潜在应用。
    Detecting unexploded landmines is critical due to the environmental pollution and potential humanitarian risks caused by buried landmines. Therefore, this study focused on developing a biosensor system capable of detecting explosives safely and efficiently. A novel transcription factor-based Escherichia coli biosensor was designed to detect 1,3-dinitrobenzene (1,3-DNB). The MexT transcription factor from Pseudomonas putida (P. putida) was identified as the fundamental sensing element in this biosensor. The study found that MexT positively regulated the transcription of PP_2827 by binding to the bidirectional promoter region between them, and significantly enhanced the expression of downstream genes under the condition of 1,3-DNB. The MexT-based biosensor for 1,3-DNB was developed by adopting different combinations of the mexT gene and promoters. The optimized biosensor demonstrated adequate sensitivity for detecting 0.1 μg/mL of 1,3-DNB in a liquid solution with satisfactory specificity and long-term stability. Subsequently, the MexT-based biosensor was integrated into a detection device to simulate the in-field exploration of explosives. The system exhibited a detection sensitivity of 0.5 mg/kg for 1,3-DNB in the sand, and realized the detection of on-site and large-scale area and the location of buried 1,3-DNB under the soil. The study provided a novel transcription factor-based bacterial biosensor and a complete system (China Earth Eye, CEE) for sensitive detection of 1,3-DNB. The good performance of this biosensor system can facilitate the development of accurate, on-site, and high-efficient exploration of explosives in real extensive minefields. Moreover, this 1,3-DNB biosensor can be complementary to the 2,4-DNT biosensor reported before, demonstrating its potential applications in military situations.
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  • 文章类型: Journal Article
    表面增强拉曼光谱(SERS),作为一种指纹识别和灵敏的分析技术,在包括生物医学在内的广泛领域具有很高的应用价值,环境保护,其他食品安全。在对永远敏感的无尽追求中,健壮,以及全面的传感和成像,进步在SERS的整个管道中不断涌现,从SERS底物和报告分子的设计,综合路线规划,仪器改进,数据预处理和分析方法。人工智能(AI)它是为了模仿并最终超越人类行为而创造的,在学习高级表示和识别具有出色自动性的复杂模式方面表现出了自己的能力。因此,面对相互交织的影响因素和爆炸性数据规模,人工智能在SERS的上述所有方面都得到了越来越多的利用,在加速系统优化和加深对基础物理和光谱数据的理解方面表现出精英效率,远远超越了人类的劳动和传统的计算。在这次审查中,通过人工智能的整合,总结了SERS的最新进展,并提供了对挑战和观点的新见解,旨在更好地将SERS推向快速通道。
    Surface-enhanced Raman spectroscopy (SERS), well acknowledged as a fingerprinting and sensitive analytical technique, has exerted high applicational value in a broad range of fields including biomedicine, environmental protection, food safety among the others. In the endless pursuit of ever-sensitive, robust, and comprehensive sensing and imaging, advancements keep emerging in the whole pipeline of SERS, from the design of SERS substrates and reporter molecules, synthetic route planning, instrument refinement, to data preprocessing and analysis methods. Artificial intelligence (AI), which is created to imitate and eventually exceed human behaviors, has exhibited its power in learning high-level representations and recognizing complicated patterns with exceptional automaticity. Therefore, facing up with the intertwining influential factors and explosive data size, AI has been increasingly leveraged in all the above-mentioned aspects in SERS, presenting elite efficiency in accelerating systematic optimization and deepening understanding about the fundamental physics and spectral data, which far transcends human labors and conventional computations. In this review, the recent progresses in SERS are summarized through the integration of AI, and new insights of the challenges and perspectives are provided in aim to better gear SERS toward the fast track.
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  • 文章类型: Journal Article
    随着人工智能的发展,由于感官终端之间繁琐的数据交互,来自感官终端的数据的爆炸性增长引起了严重的能效瓶颈问题,记忆,和计算模块。诸如小芯片技术之类的异构集成方法可以显着减少不必要的数据移动;但是,它们未能解决由于计算和感觉组件的物理分离而导致的大量时间和精力开销的基本问题。受大脑启发的传感器内神经形态计算(ISNC)为此类数据密集型应用提供了足够的空间。然而,开发ISNC系统的一个关键障碍是传感器和计算单元中部署的材料系统和制造过程之间缺乏兼容性。本研究通过实现完全CMOS兼容的TiN/HfOx基神经元阵列,成功解决了这一挑战。开发的ISNC系统展示了几个有利的特点,包括多级模拟调制,最小分散,并且电导率没有显著下降(@125°C)。这些特征实现了稳定和可重复的神经形态计算。此外,该装置表现出可调节的感官和多存储存储过程。此外,该系统以93%的高准确率实现了信息识别,以及频率选择性和显著的活动依赖性可塑性。这项工作为负担得起且高效的感觉神经形态系统提供了有希望的途径。
    With the evolution of artificial intelligence, the explosive growth of data from sensory terminals gives rise to severe energy-efficiency bottleneck issues due to cumbersome data interactions among sensory, memory, and computing modules. Heterogeneous integration methods such as chiplet technology can significantly reduce unnecessary data movement; however, they fail to address the fundamental issue of the substantial time and energy overheads resulting from the physical separation of computing and sensory components. Brain-inspired in-sensor neuromorphic computing (ISNC) has plenty of room for such data-intensive applications. However, one key obstacle in developing ISNC systems is the lack of compatibility between material systems and manufacturing processes deployed in sensors and computing units. This study successfully addresses this challenge by implementing fully CMOS-compatible TiN/HfOx-based neuristor array. The developed ISNC system demonstrates several advantageous features, including multilevel analogue modulation, minimal dispersion, and no significant degradation in conductance (@125 °C). These characteristics enable stable and reproducible neuromorphic computing. Additionally, the device exhibits modulatable sensory and multi-store memory processes. Furthermore, the system achieves information recognition with a high accuracy rate of 93%, along with frequency selectivity and notable activity-dependent plasticity. This work provides a promising route to affordable and highly efficient sensory neuromorphic systems.
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  • 文章类型: Journal Article
    新型含能材料4-氨基-3-肼基-5-甲基-1,2,4-三唑的合成,它显示了优异的性能和可靠的安全性,最近引起了人们的注意。为了充分表征这种材料,使用各种技术进行了综合分析,包括差示扫描量热法(DSC),红外光谱(IR),元素分析,和1H和13CNMR光谱。此外,三种化合物,使用单一X射线衍射进一步表征图3、5和9。X射线数据表明,广泛的氢键通过分子间相互作用影响分子结构。为了评价这些合成化合物的爆炸性能,使用EXPLO5(V6.01)计算了爆炸压力和速度。这些计算是利用实验数据进行的,包括密度和形成热。在测试的炸药中,化合物7和8表现出零氧平衡,并表现出优异的爆轰性能。化合物7达到了最高记录的爆炸压力,在34.2GPa,而化合物8显示出最高的爆炸速度,8887米s-1。
    The synthesis of the new energetic material 4-amino-3-hydrazino-5-methyl-1,2,4-triazole, which shows excellent performance and reliable safety, has drawn attention recently. To fully characterize this material, a comprehensive analysis was performed using various techniques, including differential scanning calorimetry (DSC), infrared spectroscopy (IR), elemental analysis, and 1H and 13C NMR spectroscopy. Additionally, three compounds, 3, 5 and 9, were further characterized using single X-ray diffraction. The X-ray data suggested that extensive hydrogen bonds affect molecular structure by means of intermolecular interactions. In order to evaluate the explosive properties of these synthesized compounds, detonation pressures and velocities were calculated using EXPLO5 (V6.01). These calculations were carried out utilizing experimental data, including density and heat of formation. Among the explosives tested, compounds 7 and 8 exhibited zero oxygen balance and demonstrated exceptional detonation properties. Compound 7 achieved the highest recorded detonation pressure, at 34.2 GPa, while compound 8 displayed the highest detonation velocity, at 8887 m s-1.
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  • 文章类型: Journal Article
    曝气是可持续填埋的有效方法,但可能导致填埋场内的温度升高,导致垃圾填埋场火灾或爆炸。因此,曝气通常与渗滤液再循环相结合,以控制垃圾填埋场内的高温。为了预测曝气和再循环过程中的垃圾填埋场温度,建立了考虑生物降解产生热量的局部热非平衡模型,由于蒸发和渗滤液气流而去除热量,和毛细管的作用。求解器基于有限体积方法在OpenFOAM中实现,并针对废物柱实验和原位曝气测试进行了验证。模拟结果表明,局部热平衡的假设将明显高估温度,在所研究的案例中,最大可达15°C。然后将该模型用于模拟典型的好氧垃圾填埋场,以研究不同操作条件下爆炸性气体混合物的形成和升高的温度。气体成分的模拟结果表明,曝气不会导致垃圾填埋场内的爆炸性气体。提出了一种在曝气压力(2000-4000Pa)和再循环速率(0.0001-0.0008m/s)的一组值下具有相应操作参数的温度控制的合理再循环方法,这可以为曝气和再循环组合系统的设计提供一些指导。对于给定的总添加渗滤液体积,更高的再循环率并不总是意味着更好的冷却,连续循环的冷却效果优于间歇循环。
    Aeration is an effective approach to sustainable landfilling but may lead to elevated temperatures within landfills, resulting in landfill fires or explosions. Therefore, aeration is usually combined with leachate recirculation to control the elevated temperatures within landfills. To predict landfill temperatures during aeration and recirculation, a local thermal non-equilibrium model is developed considering the heat generation of biodegradation, the heat removal due to evaporation and leachate-gas flow, and the effects of the capillary. The solver is implemented in OpenFOAM based on the finite volume method and validated against a waste-column experiment and an in-situ aeration test. The simulation results demonstrate that the assumption of local thermal equilibrium will distinctly overestimate the temperature, maximally by 15 °C in the studied case. The model is then used to simulate a typical aerobic landfill unit to investigate the formation of explosive gas mixtures and elevated temperatures under different operating conditions. The simulation results of gas composition suggest that aeration will not result in explosive gas within landfills. A reasonable recirculation method for temperature control with corresponding operating parameters under a group of values of aeration pressure (2000-4000 Pa) and recirculation rate (0.0001-0.0008 m/s) are proposed, which can provide some guides for the design of an aeration and recirculation combined system. For a given total volume of added leachate, a higher recirculation rate does not always mean better cooling, and the cooling effect of continuous recirculation is better than that of intermittent recirculation.
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  • 文章类型: Journal Article
    炸药起爆过程中形成的纳米碳材料的结构和性能一直是一个挑战,不仅是为了这些材料的设计和制造,也是为了清楚地了解炸药的起爆性能。在这里,我们使用基于量子的分子动力学方法研究了参与2,4,6-三氨基-1,3,5-三硝基苯(TATB)爆炸的凝聚相碳的动态演化过程。各种碳结构,如,类石墨烯,钻石般的,和“双亲”,在不同的压力下获得。从Csp2-到sp3-杂种的过渡,由六原子到非六原子环的转换驱动,在高压下被检测到。揭示了以石墨烯状碳层为主的类金刚石碳的紧密结合成核机制。石墨烯样层很容易在早期阶段构建,与周围的碳原子或碎片连接形成四面体结构,有大量的sp3杂化碳。之后,变形的碳层通过五元环内的碳原子之间的键合进一步彼此聚结,形成钻石状的核.在类金刚石碳形核过程中检测到复杂的“黄体”构型,这说明了爆炸纳米金刚石的成核和生长将伴随着类石墨烯层的共生。
    The structure and properties of nano-carbon materials formed in explosives detonation are always a challenge, not only for the designing and manufacturing of these materials but also for clearly understanding the detonation performance of explosives. Herein, we study the dynamic evolution process of condensed-phase carbon involved in 2,4,6-Triamino-1,3,5-trinitrobenzene (TATB) detonation using the quantum-based molecular dynamics method. Various carbon structures such as, graphene-like, diamond-like, and \"diaphite\", are obtained under different pressures. The transition from a C sp2- to a sp3-hybrid, driven by the conversion of a hexatomic to a non-hexatomic ring, is detected under high pressure. A tightly bound nucleation mechanism for diamond-like carbon dominated by a graphene-like carbon layer is uncovered. The graphene-like layer is readily constructed at the early stage, which would connect with surrounding carbon atoms or fragments to form the tetrahedral structure, with a high fraction of sp3-hybridized carbon. After that, the deformed carbon layers further coalesce with each other by bonding between carbon atoms within the five-member ring, to form the diamond-like nucleus. The complex \"diaphite\" configuration is detected during the diamond-like carbon nucleation, which illustrates that the nucleation and growth of detonation nano-diamond would accompany the intergrowth of graphene-like layers.
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