Noether＇s theorem and one-step corrections method for holonomic system

In this paper, a new computational method for improving the accuracy of numerically computed solutions is introduced. The computational method is based on the one-step method and conserved quantities of holonomic systems are considered as kinematical constraints in this method.

One-step green method to prepare progressive burning gun propellant through gradient denitration strategy

Gradiently denitrated gun propellant(GDGP)prepared by a“gradient denitration”strategy is obviously superior in progressive burning performance to the traditional deterred gun propellant.Currently,the preparation of GDGP employed a tedious two-step method involving organic solvents,which hinders the large-scale preparation of GDGP.In this paper,GDGP was successfully prepared via a novelty and environmentally friendly one-step method.The obtained samples were characterized by FT-IR,Raman,SEM and XPS.The results showed that the content of nitrate groups gradiently increased from the surface to the core in the surface layer of GDGP and the surface layer of GDGP exhibited a higher compaction than that of raw gun propellant,with a well-preserved nitrocellulose structure.The denitration process enabled the propellant surface with regressive energy density and good progressive burning performance,as confirmed by oxygen bomb and closed bomb test.At the same time,the effects of different solvents on the component loss of propellant were compared.The result showed that water caused the least component loss.Finally,the stability of GDGP was confirmed by methyl-violet test.This work not only provided environmentally friendly,simple and economic preparation of GDGP,but also confirmed the stability of GDGP prepared by this method.

Constraint Stabilization and One-Step Correction Method for Dynamical Systems

A computational method of constraint stabilization and correction is introduced. The method is based on the Baumgart＇s one-step method. Constraint conditions are addressed to stabilize and correct the solution. Two examples are given to illustrate the results of the method.

A LOW-PRESSURE AND ONE-STEP METHOD FOR THE SYNTHESIS OF ALKYLIDYNETRICOBALT NONACARBONYL CLUSTERS:RCCo_8(CO)_9

Metal clusters RCCo_3(CO)_9(R-H,C1,Br,CH_3,Ph) were prepared in 18.8-57.3% yields from the reaction of cobalt(Ⅱ)salt and RCX_a under mild PTC conditions(latm CO,25℃).The cobalt salt was reduced to Co(CO)_4 in the presence of Na_3S_2O_4.

The First Global Map of Atmospheric Ammonia(NH_(3)) as Observed by the HIRAS/FY-3D Satellite

Atmospheric ammonia(NH_(3)) is a chemically active trace gas that plays an important role in the atmospheric environment and climate change. Satellite remote sensing is a powerful technique to monitor NH_(3) concentration based on the absorption lines of NH_(3) in the thermal infrared region. In this study, we establish a retrieval algorithm to derive the NH_(3)column from the Hyperspectral Infrared Atmospheric Sounder(HIRAS) onboard the Chinese Feng Yun(FY)-3D satellite and present the first atmospheric NH_(3) column global map observed by the HIRAS instrument. The HIRAS observations can well capture NH_(3) hotspots around the world, e.g., India, West Africa, and East China, where large NH_(3) emissions exist. The HIRAS NH_(3) columns are also compared to the space-based Infrared Atmospheric Sounding Interferometer(IASI)measurements, and we find that the two instruments observe a consistent NH_(3) global distribution, with correlation coefficient(R) values of 0.28–0.73. Finally, some remaining issues about the HIRAS NH_(3) retrieval are discussed.

Potential-dependent insights into the origin of high ammonia yield rate on copper surface via nitrate reduction:A computational and experimental study

Focusing on revealing the origin of high ammonia yield rate on Cu via nitrate reduction(NO3RR),we herein applied constant potential method via grand-canonical density functional theory(GC-DFT)with implicit continuum solvation model to predict the reaction energetics of NO3RR on pure copper surface in alkaline media.The potential-dependent mechanism on the most prevailing Cu(111)and the minor(100)and(110)facets were established,in consideration of NO_(2)_(−),NO,NH_(3),NH_(2)OH,N_(2),and N_(2)O as the main products.The computational results show that the major Cu(111)is the ideal surface to produce ammonia with the highest onset potential at 0.06 V(until−0.37 V)and the highest optimal potential at−0.31 V for ammonia production without kinetic obstacles in activation energies at critical steps.For other minor facets,the secondary Cu(100)shows activity to ammonia from−0.03 to−0.54 V with the ideal potential at−0.50 V,which requires larger overpotential to overcome kinetic activation energy barriers.The least Cu(110)possesses the longest potential range for ammonia yield from−0.27 to−1.12 V due to the higher adsorption coverage of nitrate,but also with higher tendency to generate di-nitrogen species.Experimental evaluations on commercial Cu/C electrocatalyst validated the accuracy of our proposed mechanism.The most influential(111)surface with highest percentage in electrocatalyst determined the trend of ammonia production.In specific,the onset potential of ammonia production at 0.1 V and emergence of yield rate peak at−0.3 V in experiments precisely located in the predicted potentials on Cu(111).Four critical factors for the high ammonia yield and selectivity on Cu surface via NO3RR are summarized,including high NO3RR activity towards ammonia on the dominant Cu(111)facet,more possibilities to produce ammonia along different pathways on each facet,excellent ability for HER inhibition and suitable surface size to suppress di-nitrogen species formation at high nitrate coverage.Overall,our work provides comprehensive potential-dependent insights into the reaction details of NO3RR to ammonia,which can serve as references for the future development of NO3RR electrocatalysts,achieving higher activity and selectivity by maximizing these characteristics of copper-based materials.

Improved method for inducing chronic atrophic gastritis in mice

BACKGROUND Chronic atrophic gastritis(CAG)is a common disease of the digestive system with pathological characteristics of a decreasing number,or disappearance,of inherent glands of the gastric mucosa.CAG has been defined as a precancerous condition of gastric cancer.Intestinal metaplasia or intraepithelial neoplasia accompanying atrophied glands of the stomach is regarded as one of the most important precancerous lesions of gastric cancer.As a common malignant tumour,gastric cancer remains without a satisfactory therapy and its pathogenesis remains unclear,seriously threatening human life.Therefore,some scholars have proposed to prevent the incidence of gastric cancer by avoiding precancerous lesions.If CAG can be reversed,the incidence of gastric cancer can be substantially reduced.To reverse and prevent CAG and study its pathogenesis and therapy,it is necessary to develop an ideal,safe,stable,animal model.AIM To study a rapid,stable,and safe method of establishing a mouse model of human CAG.METHODS Six-week-old Kunming mice were divided into a phosphate buffered solution control group,a Helicobacter pylori(H.pylori)group,an N-methyl-N'-nitroguanidine(MNNG)group,an ammonia water group,and a group combining H.pylori,MNNG,and ammonia water(hereinafter referred to as the combined group).The mice were administrated with drinking water containing ammonia or infected with H.pylori through gavage.At the 30th,60th,90th,and 120th day after the last H.pylori infection,mice were selected randomly to collect their gastric mucosa for hematoxylin eosin staining,terminal nick-end labelling staining detection,and immunohistochemical staining for Bax and Bcl-2.In addition,H.pylori was isolated,cultured,and identified,and its extent of colonisation calculated.Blood was collected to detect inflammatory factors interleukin(IL)-1β,IL-8,and tumor necrosis factor(TNF)-αand immune function markers CD4 and CD8 to confirm successful establishment of the CAG model.RESULTS The combined group showed slight CAG at the 90th day and moderate CAG at the 120th day,while other groups did not show CAG at that time.CONCLUSION The combination of H.pylori,MNNG,and ammonia is an effective method of developing a mouse model of human CAG.

Synthesis of Codon-optimized Human Interleukin-18 Gene by Combination of Chemical and Enzymatic Method

According to the amino acid sequence and codon preference of E. coli, the human interleukin-18（IL-18） gene was optimized to avoid the rare codons. The total length of the synthesized gene is 571 bp; 18 oligonucleotides, DNA fragments were designed and synthesized by the phosphoramidite four-step chemical method. The whole DNA sequence was synthesized by a one-step total gene synthesis method, and then inserted in pUC18 vector. Five positive clones identified by blue-white colony screening were sent to Shanghai Sangon Biological Engineering Technology and Service Co., Ltd. for sequencing. The sequencing result shows that one clone contained the complete correct gene in all the five positive clones.

One-Step Multiplex PCR for Simultaneous Detection and Identification of Eight Medically Important <i>Candida</i>Species

Recently, the incidence of Candida infections has substantially increased. Conventional identification methods for Candida species are technically difficult to conduct and cannot accurately distinguish each species. The purpose of the present study was to design primers to identify and detect simultaneously eight medically important Candida species using one-step multiplex PCR. PCR primers were designed based on partial sequences of intergenic spacer (IGS) and internal transcribed spacer (ITS) genes of eight medically important Candida species. These primers were able to distinguish each Candida species and did not display cross-reactivity with representative Candida species other than the eight Candida species. Moreover, our developed one-step multiplex PCR method is accurate, specific, cost-effective, time-saving, and worked without requiring DNA extraction.

Simulation of bulk metal forming processes using one-step finite element approach based on deformation theory of plasticity

The bulk metal forming processes were simulated by using a one-step finite element(FE)approach based on deformation theory of plasticity,which enables rapid prediction of final workpiece configurations and stress/strain distributions.This approach was implemented to minimize the approximated plastic potential energy derived from the total plastic work and the equivalent external work in static equilibrium,for incompressibly rigid-plastic materials,by FE calculation based on the extremum work principle.The one-step forward simulations of compression and rolling processes were presented as examples,and the results were compared with those obtained by classical incremental FE simulation to verify the feasibility and validity of the proposed method.

In-situ-selective-UV crosslinking fabrication of solid liquid host guest electrolyte: A facile one-step method realizing highly flexible electrochromic device

Flexible electrochromic devices (FECDs) are promising candidates for the next generation of wearable electronics due to their low operating voltage and energy consumption. For the flexible electrochromic devices, the electrolyte is an important component. Typically, the electrolyte needs to be formulated according to the device structure and usage scenario. A high-performance electrolyte involves consideration of many factors, including choosing the right polymer, solvent, curing agent, and ion type to satisfy particular device specifications. In this work, a ultraviolet-curable solid–liquid host–guest (UV-SLHG) electrolyte is developed. Several aspects of performance are improved by introducing the solid–liquid coexisting microstructure without changing the electrolyte formulation, including excellent adhesion, a 30% increase in tensile characteristics, and a seven-fold increase in ionic conductivity when compared to a fully cured solid-state electrolyte. More importantly, the unique advantage of SLHG electrolytes lies that the thickness will not change significantly during bending. The FECD made by using the UV-SLHG-based electrolyte sustained 10,000 bending cycles at the bending radius of 2.5 mm while maintaining outstanding optical modulation. A wearable ring-type ECD and a battery-free FECD wine label were made as demonstrators. The UV-SLHG strategy is not only suitable for the FECDs but also universally applicable to other electrolyte-based of flexible electronics such as flexible capacitors and batteries.

One-step Eco-friendly Fabrication of Antibacterial Polyester Via On-line Amination Reaction by Melt Coextrusion

The work is dedicated to develop a one-step eco-friendly method to prepare antibacterial polyethylene terephthalate(PET).We report a one-step eco-friendly method to manufacture antibacterial PET via on-line amination reaction by melt coextrusion.Beside evenly mixing of poly(hexamethylene guanidine)(PHMG)and PET in the melt coextrusion procedure,the amination reaction also occurred between PHMG and PET under high temperature(230-270℃).The antibacterial ability of composite PET showed obvious PHMG concentration dependence,and antibacterial activity reached more than 99%when PHMG content was 2.5 wt%.Moreover,LIVE/DEAD fluorescence test further confirmed that the composite PET could kill bacteria quickly and efiectively(within 30 min);while negligible cytotoxicity was observed to HSF and HUVEC cells.Onestep eco-friendly fabrication of composite antibacterial PET was accomplished by on-line melt coextrusion.The composite antibacterial PET has potential use in multiple fields to combat with pathogenic including textiles,packaging materials,decoration materials and biomedical devices,etc.

Optimization of extraction method for quantitative analysis of Si/Al in soil phytoliths

Elemental information carried by phytoliths plays a crucial indicative role in geochemical research.For instance,it serves as an indicator of the carbon pool effect in phytoliths and aids in the elucidation of silicon sources.However,early extraction methods for soil phytoliths primarily focused on obtaining their morphological and quantitative information,lacking efficient techniques for quantitative elemental analysis.In this study,we aimed to extract Si/Al information from soil phytoliths.Considering the need for complete extraction of phytolith,six extraction methods were developed and further by alkaline dissolution to determine Si/Al.Six methods were compared in terms of enrichment capacity,the weight of extracted phytoliths,and Si/Al differences.The results indicated that the addition of Ammonia-Catechol in the commonly used heavy liquid flotation method effectively improved phytolith extraction capability and the accuracy of Si/Al results.Additionally,the inclusion of an acetic acid step before alkaline dissolution further removed surface-adsorbed impurities and enhanced the analytical quality of Si/Al in phytolith.The comparison of the data in this study with other published data shows that our method is relatively robust.The improved method proposed in this study can provide a new idea for the quantitative analysis of other elements in soil phytoliths.

Synthesis of tetramethyl ammonium hydroxide by cell diaphragm electrolytic method

Under the conditions of tetramethyl ammonia chloride (TMAC) used as starting material, Ti-based Dimensionally Stable Anode (DSA), stainless steel used as cathode and Nafion 900 cation membrane as cell diaphragm, this paper studies the synthesis of tetramethyl ammonium hydroxide (TMAH) by cell diaphragm electrolytic method, examining not only the effects of current density, concentration of starting material and cell temperature, on the product purity and current efficiency, but also the effects of electrolyte circulation rate on the service life of Ti-based DSA. The experiment puts forward an optimum processing condition, and experimental findings show that preparing TMAH by using this technique can obtain a current efficiency 74.7% and get product with a purity greater than 99.9%.

玉米基肥期农田土壤氨挥发量与近地表氨浓度相关性研究

农田氨排放量与近地表氨浓度密切相关,但两者能否相互转换还缺乏系统研究。基于此,以近地表氨浓度经典方法(被动法)为主要使用方法,以传统海绵法为对照方法,在豫南砂姜黑土开展5种典型施肥处理玉米季基肥期氨排放量与近地表氨浓度的相关性研究。结果发现,不同施肥处理的氨挥发峰值均出现在施肥后的2-4 d,第5天开始显著降低,第8天之后基本与对照无明显差异;不同处理的氨累计排放量差别较大,排序为TR>OPT>SOPT>HK>CK,累计排放量分别为7.68、5.48、3.37、2.78和0.22 kg·hm^(-2);同时发现,不同施肥处理近地表氨浓度也有相同趋势,峰值同样出现在施肥后的2-4 d,第5天开始显著降低,平均氨质量浓度排序为TR>OPT>SOPT>HK>CK,均值分别为17.5、11.6、10.7、8.21和1.70μg·m^(-3)。线性相关性分析表明,施肥后前8 d不同施肥处理的氨挥发量与近地表氨浓度的线性相关性较强,而8 d之后两者的相关性较弱,说明近地表氨浓度和农田氨挥发量的相关性与农田氨挥发量的高低有关。除此之外,不同方法中被动法对低施氮量和缓释肥的估算优于排放因子法,而排放因子法对高施肥条件下氨挥发量的估算优于被动法。整体而言,被动方法估算氨挥发量的相对误差介于-15.9%-17.5%之间,排放因子法相对误差介于-54.3%-81.8%之间,被动方法明显具备更高的估算精度。以上结果说明,被动方法可以潜在替代传统氨监测方法估算大区域农田氨挥发量,但估算精度主要集中在高氨排放期。

蒸氨法制备绿铜锌矿晶体的工艺研究

本文以碱式碳酸铜、碱式碳酸锌和浓氨水为原料,采用蒸氨法合成绿铜锌矿。通过XRD、TGA、SEM-Mapping、FT-IR等表征手段,研究工艺条件对绿铜锌矿晶体结构的影响规律。实验表明,铜浓度为120 g/L,铜锌摩尔比分别为3∶2、1∶1、2∶3时,沉淀产物中的晶体由绿铜锌矿与孔雀石组成,且孔雀石数量随铜锌摩尔比的降低而减少。当铜锌摩尔比为2∶3,铜浓度由120 g/L降低至80 g/L时,孔雀石晶体的数量进一步减少。在铜锌摩尔比为2∶3,铜浓度为80 g/L的条件下,沉淀得到单一物相的绿铜锌矿晶体,为蒸氨法控制合成绿铜锌矿提供了数据支撑。

考虑电转氨和生物质废能转换的农村化工综合能源系统低碳调度方法

农村地区能源绿色转型发展是构建现代能源体系的重要组成部分,而引入化工类产业在促进乡村振兴的同时,也带来严重的污染问题。因此,研究农村化工生产脱碳及园区能源结构优化对实现“双碳”目标和农村现代化具有重要意义。该文提出一种考虑电转氨和生物质废能转换的农村化工园区综合能源系统低碳调度方法,通过利用富余可再生资源产生绿氨,考虑碳-氨耦合过程,将绿氨与碳捕集设备联合运行促进化工生产,同时利用生物质能替代燃煤发电,三者构建化工园区联合生产单元,进而降低园区碳排放及运行成本。首先,建立电转氨两阶段模型和生物质废能转换模型及其能流关系。其次,构建化工园区联合生产单元,分析其电、热、气以及碳能量耦合特性。再次,引入有机朗肯循环(organic Rankine cycle,ORC)余热发电和负荷侧综合需求响应,综合优化化工园区联合生产单元。最后,以化工园区运行总成本最低为目标,通过不同场景对比分析证明所提调度方法对化工园区有较好的改善作用,可为农村产业结构调整和能源转型提供理论支持。

纳氏试剂分光光度法测定医疗废水氨氮的研究

分别选择早晨、中午、下午3个时间点对附属医院的医疗出水水样进行采样并进行氨氮测定,测定结果均值依次为7.22、7.72、7.74 mg·L^(-1),STD依次为0.006、0.015、0.012,RSD依次为0.008、0.019、0.016,具有统计学意义,且该实验结果基本符合《医疗机构水污染物排放标准》(GB18466—2005)的氨氮排放标准。对比3个时间段的测定结果,发现早晨医疗出水的氨氮质量浓度略低,中午与下午医疗出水的氨氮质量浓度近似相当,这是因为医院的医疗出水口氨氮质量浓度是动态变化的,其受气温影响。当地疾控中心需要每周定点定时对医疗机构污水采样进行检测氨氮排放是否达标,防止对居民的生活环境造成二次污染。

3-羟基丙酸甲酯加氢合成1,3-丙二醇反应中La对Cu/SiO_(2)催化剂的修饰作用

[目的] 3-羟基丙酸酯加氢制备1,3-丙二醇(1,3-PDO)过程中存在β-羟基脱除等副反应,导致1,3-PDO的选择性和收率不高,其中高效催化剂的开发是解决该问题的关键.[方法]采用蒸氨法制备了不同添加量La修饰的20Cu/SiO_(2)催化剂,对其进行催化性能评价,并通过H_(2)程序升温还原(H_(2)-TPR)、X射线衍射(XRD)、透射电子显微镜(TEM)、X射线光电子能谱(XPS)和N_(2)物理吸附-脱附对其进行表征.[结果] 20Cu-0.50La/SiO_(2)的催化性能最佳,它显著地提高了3-羟基丙酸甲酯(3-HMP)加氢制1,3-PDO的催化活性和稳定性,其中3-HMP转化率为91.8%,1,3-PDO的选择性和收率分别为85.2%和78.2%.这是在高液时空速(LHSV=0.10 h^(-1))的条件下取得的最佳结果.[结论] La的加入与Cu产生了强相互作用,增强了催化剂中Cu的分散性,同时提高了Cu^(+)物种表面浓度,使活性Cu的比表面积增加,从而提高了加氢反应的活性和稳定性.

海水养殖尾水中NH_(4)^(+)-N去除技术的机理与工艺研究进展

总结了海水养殖尾水中NH_(4)^(+)-N的来源及特点,NH_(4)^(+)-N去除技术的机理与功能微生物、工艺应用及其微生物分布等,重点对海水养殖尾水中NH_(4)^(+)-N去除技术的机理与工艺应用进行了阐述。好氧氨氧化微生物主要包括氨氧化细菌(AOB)、氨氧化古菌(AOA)及全程硝化菌(comammox),厌氧氨氧化微生物主要包括厌氧氨氧化细菌(AnAOB)。基于好氧氨氧化微生物原理去除NH_(4)^(+)-N的主要工艺技术包括移动床生物膜反应器(MBBR)、曝气生物滤池(BAF)、人工湿地和生态塘等;基于厌氧氨氧化菌处理海水养殖尾水的主要工艺技术有厌氧流化床、厌氧固定床等。指出工艺应用与微生物种群结构之间关系的研究不足。富集氨氧化微生物从而实现经济高效脱氮是未来工艺研究的重点方向。