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X–ray diffraction in different crystal cuts under a temperature gradient 温度梯度下不同晶体切割的x射线衍射
IF 2.8 3区 物理与天体物理 Q3 CHEMISTRY, PHYSICAL Pub Date : 2026-01-20 DOI: 10.1016/j.radphyschem.2026.113654
V.R. Kocharyan, T.G. Dovlatyan, V.V. Margaryan, Yu.M. Cherepennikov, A.E. Movsisyan, V.N. Aghabekyan, R.K. Mirzoyan, H.G. Margaryan, A.V. Shahverdyan, M.H. Mesropyan, S.N. Noreyan
The peculiarities of X–ray diffraction from atomic planes of the same family in different cuts of quartz single crystals under the temperature gradient are investigated. Quartz single crystals were shaped into rectangular parallelepiped plates with X- and Z-cuts, with one heated edge oriented parallel to the (10 1 0) reflecting planes. The experiments were carried out using collimated polychromatic X–rays in symmetric Laue geometry. For different values of the temperature gradient applied to the crystal, both sectional topograms at different distances from the crystal and spectra of the reflected beam were obtained. The experimental results showed that the parameters of the deformation field formed at the same temperature gradient applied perpendicularly to the reflecting planes (10 1 0) of the crystal with different cuts are significantly different: for the same heat applied to the single crystal, the bending radius in the X–cut sample was significantly smaller than the bending radius of the Z–cut sample.
研究了温度梯度下石英单晶不同切口中同族原子面x射线衍射的特性。石英单晶被塑造成具有X和z切割的矩形平行六面体板,其中一个加热边缘平行于(10 1)的反射面。实验是在对称劳埃几何中使用准直多色x射线进行的。在不同的温度梯度下,得到了晶体在不同距离处的截面形貌和反射光束的光谱。实验结果表明,在垂直施加于不同切割晶体的反射面(10 10)的相同温度梯度下形成的变形场参数有明显不同:对单晶施加相同的热量,x切割样品中的弯曲半径明显小于z切割样品的弯曲半径。
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引用次数: 0
Assessment of the impact of the irradiation process on the final properties of radiation-resistant polypropylene materials used for medical devices 辐照过程对医疗器械用抗辐射聚丙烯材料最终性能影响的评估
IF 2.8 3区 物理与天体物理 Q3 CHEMISTRY, PHYSICAL Pub Date : 2026-01-20 DOI: 10.1016/j.radphyschem.2026.113612
Flavie Petros , Hélène Garay , Aurélie Taguet , Belkacem Otazaghine , Rodolphe Sonnier , Nicolas Ludwig , Abbas Nasreddine , Florent Kuntz , Yves Bayon , Sophie Rouif
The global demand for sterile medical devices is increasing due to technological advancements and growing health care needs. Although Electron beam (EB) and X-ray have existed for a long time, they have been less utilized compared to other sterilization methods such as ethylene oxide and Gamma irradiation. Currently, their application is developing, offering new possibilities in response to a rapidly expanding sterilization market. This study assesses the impact of these irradiation techniques on polypropylene (PP) materials used in medical devices, focusing on their mechanical properties, structural changes, and color stability. PP is known for its sensitivity to irradiation, which makes the evaluation of its properties under different irradiation conditions particularly relevant. Three different PP grades, with varying radiotolerance claims, were exposed to controlled irradiation doses (30, 45, and 85 kGy). Analyses including electron spin resonance (ESR), rheology, tensile testing and colorimetry were carried out. They were also employed in conjunction with principal component analysis (PCA). The results allowed to evaluate irradiation-induced modification. Results indicate that Gamma irradiation induces the most significant degradation due to its low dose rate, leading to increased chain scission and oxidation effects. E-beam irradiation has the least impact, while X-ray effects are generally lower to Gamma irradiation at equivalent doses. The study highlights the importance of selecting appropriate PP formulations to ensure optimal post-irradiation performance, particularly in the context of transitioning from traditional sterilization methods to E-beam or emerging X-ray technology.
由于技术进步和不断增长的医疗保健需求,全球对无菌医疗设备的需求正在增加。虽然电子束(EB)和x射线已经存在了很长时间,但与环氧乙烷和伽马辐射等其他灭菌方法相比,它们的应用较少。目前,它们的应用正在发展,为应对迅速扩大的灭菌市场提供了新的可能性。本研究评估了这些辐照技术对医疗器械中使用的聚丙烯(PP)材料的影响,重点关注其机械性能、结构变化和颜色稳定性。PP因其对辐照的敏感性而闻名,这使得评估其在不同辐照条件下的性能尤为重要。三种不同等级的PP,具有不同的放射耐受性声明,暴露在受控的辐照剂量(30、45和85千吉)下。进行了电子自旋共振(ESR)、流变学、拉伸测试和比色分析。它们还与主成分分析(PCA)结合使用。结果可用于评价辐照诱导的修饰。结果表明,γ辐射由于其低剂量率,导致了最显著的降解,导致链断裂和氧化效应增加。电子束辐照的影响最小,而在相同剂量下,x射线的影响一般低于伽马辐照。该研究强调了选择合适的PP配方以确保最佳辐照后性能的重要性,特别是在从传统灭菌方法过渡到电子束或新兴x射线技术的背景下。
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引用次数: 0
Accessible self-attenuation correction method for activity concentration measurement in bulk soil using HPGe gamma spectrometry 利用HPGe能谱法测量块状土壤中活性浓度的自衰减校正方法
IF 2.8 3区 物理与天体物理 Q3 CHEMISTRY, PHYSICAL Pub Date : 2026-01-19 DOI: 10.1016/j.radphyschem.2026.113627
Sahar Saleh Al-Horr , Kok Siong Khoo , Imran Yusuff
The presence of natural and artificial radioactivity in soil requires reliable monitoring methods to ensure environmental and public safety. High Purity Germanium (HPGe) detectors remain the benchmark for gamma spectrometry, but their accuracy is influenced by factors such as sample geometry, counting duration, and self-attenuation. This study offers a straightforward way to correction self-attenuation when determining activity concentrations in bulk soil samples, using a procedure that can be applied directly without the need for simulation tools or specialized software. The correction equation incorporates key parameters namely geometry, counting time, and self-attenuation which is applicable under routine laboratory conditions using standard spreadsheet tools. Application of the method to bulk soil samples of varying geometries, measured over 3 and 24 h periods, improved the estimation of 226Ra, 232Th, and 40K activity concentrations by up to 7.3 %,8.9 % and 6.3 % respectively. Validation against using the IAEA-375 reference soil showed that the relative error decreased and the adjusted values were in good agreement with the certified data. The method offers a workable option for labs that deal with environmental radioactivity, especially when measurements are not perfectly ideal.
土壤中天然和人工放射性的存在需要可靠的监测方法,以确保环境和公共安全。高纯锗(HPGe)探测器仍然是伽马能谱的基准,但其准确性受到样品几何形状、计数持续时间和自衰减等因素的影响。本研究提供了一种直接的方法来校正自衰减,当确定散装土壤样品中的活性浓度时,使用的程序可以直接应用,而不需要模拟工具或专门的软件。校正方程包含关键参数,即几何形状、计数时间和自衰减,适用于常规实验室条件下使用标准电子表格工具。将该方法应用于不同几何形状的散装土壤样品,在3和24 h的时间内测量,226Ra, 232Th和40K活性浓度的估计分别提高了7.3%,8.9%和6.3%。与IAEA-375标准土的对比验证表明,校正后的相对误差减小,校正值与认证数据吻合较好。这种方法为处理环境放射性的实验室提供了一种可行的选择,特别是在测量不完全理想的情况下。
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引用次数: 0
Monitoring of structural changes in materials under the exposure of ionization radiation using a vibrating wire 用振动导线监测电离辐射下材料的结构变化
IF 2.8 3区 物理与天体物理 Q3 CHEMISTRY, PHYSICAL Pub Date : 2026-01-17 DOI: 10.1016/j.radphyschem.2026.113651
S.G. Arutunian , N.M. Manukyan , S.A. Hunanyan , A.V. Margaryan , E.G. Lazareva , M. Chung , L.M. Lazarev , G.S. Harutyunyan , D.A. Poghosyan , N.B. Margaryan , N.R. Aghamalyan , M.N. Nersisyan
Ionizing radiation (X-rays, proton beams) causes structural changes in materials. If a vibrating metallic wire is subjected to such radiation, the natural frequency of the wire is affected as a result of changes in the elastic characteristics of the material. This paper presents the results of experiments on the impact of proton beam with energy 18 MeV on the structure of stainless steel wire. In case of proton irradiation an irreversible change in the wire frequency was observed, which indicated residual changes in the structure of the wire material. X-ray diffractometry methods were used to analyze the structural changes.
电离辐射(x射线、质子束)引起材料的结构变化。如果振动的金属丝受到这种辐射,由于材料弹性特性的变化,金属丝的固有频率受到影响。本文介绍了能量为18mev的质子束对不锈钢丝结构影响的实验结果。在质子辐照的情况下,观察到线材频率的不可逆变化,这表明线材结构的残余变化。采用x射线衍射法分析其结构变化。
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引用次数: 0
From Sc to Y in CaCu3MSe4: Bonding reorganization, band-edge alignment, and transport tunability from first principles ccu3mse4中从Sc到Y的键合重组、带-边缘对准和第一原理的输运可调性
IF 2.8 3区 物理与天体物理 Q3 CHEMISTRY, PHYSICAL Pub Date : 2026-01-17 DOI: 10.1016/j.radphyschem.2026.113634
G. Murtaza , Jaber M. Asiri , Hilal Ali Al Hadhrami , Majid Al-Ruqeishi , Harith Mohamed Al-Azri , Aarfa A. Yagob , Saad Alshammari
This work explores the structural, electronic, optical, and thermoelectric properties of CaCu3ScSe4 and CaCu3YSe4 using first-principles calculations and Boltzmann transport theory. Swapping Sc with Y leads to notable shifts in bonding and carrier behavior. CaCu3ScSe4 displays a slightly wider band gap, stronger covalent bonding, and increased mechanical stiffness. It also shows a higher Seebeck coefficient, suggesting better thermoelectric efficiency under n-type doping at elevated temperatures. In contrast, CaCu3YSe4 features a lower band gap and more delocalized Y–4d conduction states, which enhance electron mobility and electrical conductivity. Charge density analysis show Sc–Se bonds are more localized, while Y–Se bonds appear broader and more diffuse. Optically, both compounds absorb strongly in the visible to UV range. CaCu3ScSe4 exhibits a higher refractive index, whereas CaCu3YSe4 has a sharper absorption edge, making it more responsive at shorter wavelengths. The band-edge potentials are also calculated to assess the photocatalytic water-splitting potential. These results reveal that cation substitution in CaCu3MSe4 (M = Sc, Y) offers a tunable pathway for optimizing thermoelectric and optoelectronic performance. Strategic element selection could be key to tailoring materials for specific device applications.
本研究利用第一性原理计算和玻尔兹曼输运理论探讨了CaCu3ScSe4和CaCu3YSe4的结构、电子、光学和热电性质。Sc与Y交换导致键和载流子行为的显著变化。CaCu3ScSe4表现出略宽的带隙、更强的共价键和更高的机械刚度。它还显示出更高的塞贝克系数,这表明n型掺杂在高温下具有更好的热电效率。相比之下,CaCu3YSe4具有更低的带隙和更多的离域Y-4d导态,这增强了电子迁移率和导电性。电荷密度分析表明,Sc-Se键更局域化,而Y-Se键更宽、更分散。光学上,这两种化合物在可见光到紫外线范围内都有很强的吸收。CaCu3ScSe4具有更高的折射率,而CaCu3YSe4具有更锐利的吸收边缘,使其在更短的波长下具有更高的响应性。还计算了带边电位,以评估光催化水分解电位。这些结果表明,CaCu3MSe4 (M = Sc, Y)中的阳离子取代为优化热电和光电子性能提供了可调的途径。策略性元素选择可能是为特定设备应用定制材料的关键。
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引用次数: 0
Mesoporous Ag–CeO2 nanocomposite as oxigation catalyst synthesized by various energy pulsed electron beams 以不同能量脉冲电子束合成介孔Ag-CeO2纳米复合材料作为氧化催化剂
IF 2.8 3区 物理与天体物理 Q3 CHEMISTRY, PHYSICAL Pub Date : 2026-01-17 DOI: 10.1016/j.radphyschem.2026.113638
V.G. Ilves , M.E. Balezin , S. Yu Sokovnin , A.S. Gerasimov , E.G. Kalinina , D.S. Rusakova , P.M. Korusenko
The Ag–CeO2 nanocomposite (1.3 at. % Ag) with a specific surface area (126.5 m2/g), large pore volume (0.11 cm3/g) and relatively large Ag nanoparticles (51 ± 3 nm) was obtained using electron beams with different electron energies (from 40 to 500 keV) and investigated for the catalytic oxidation of the popular dye methyl violet (MV). Silver nitrate was used as a precursor. The deposition of Ag nanoparticles was carried out on CeO2 nanoparticles of 3–5 nm in size, previously obtained by pulsed electron beam evaporation (PEBE) in a vacuum. According to X-ray diffraction and elemental analysis using X-ray photoemission spectroscopy, there were no parasitic impurities in the synthesized product. The composite contained two cubic phases: CeO2 and Ag. TEM micrographs depicted the formation of agglomerated non-symmetrical NPs in form of 3D spatial nanostructures in the form of “clouds”. The “clouds” were constructed from CeO2 nanoparticles, smaller than 5 nm in size, which were coated with scatterings of individual and chain spherical Ag nanoparticles, ranging in size from 10 to 200 nm%. EDX spectra confirmed the presence of the main elements in the composite. XPS analysis showed that the composite contained only non-stoichiometric cerium dioxide (CeO1.8) with Ag0 NPs on the surface of the oxide NPs. The deposition of Ag nanoparticles on CeO2 nanoparticles led to an increase in the photocatalytic activity of the latter by 23 %. The stability of CeO2 aqueous suspensions was studied using Darvan-CN and sodium citrate dispersants.
Ag-CeO2纳米复合材料(1.3 at。利用不同电子能量(40 ~ 500 keV)的电子束,获得了比表面积(126.5 m2/g)、大孔体积(0.11 cm3/g)和较大的Ag纳米粒子(51±3 nm),并对常用染料甲基紫(MV)的催化氧化进行了研究。硝酸银被用作前体。Ag纳米粒子的沉积是在3-5 nm大小的CeO2纳米粒子上进行的,CeO2纳米粒子是之前在真空中通过脉冲电子束蒸发(PEBE)获得的。根据x射线衍射和x射线光发射光谱元素分析,合成产物中没有寄生杂质。该复合材料含有两种立方相:CeO2和Ag。TEM显微照片描绘了以“云”形式形成的非对称纳米粒子的三维空间纳米结构。这种“云”是由CeO2纳米颗粒构成的,其尺寸小于5纳米,表面覆盖着分散的单个和链状球形银纳米颗粒,尺寸从10到200纳米%不等。EDX光谱证实了复合材料中主要元素的存在。XPS分析表明,该复合材料仅含有非化学计量的二氧化铈(CeO1.8),氧化NPs表面有Ag0 NPs。银纳米粒子沉积在CeO2纳米粒子上,使后者的光催化活性提高了23%。采用Darvan-CN和柠檬酸钠作为分散剂,研究了CeO2水溶液悬浮液的稳定性。
{"title":"Mesoporous Ag–CeO2 nanocomposite as oxigation catalyst synthesized by various energy pulsed electron beams","authors":"V.G. Ilves ,&nbsp;M.E. Balezin ,&nbsp;S. Yu Sokovnin ,&nbsp;A.S. Gerasimov ,&nbsp;E.G. Kalinina ,&nbsp;D.S. Rusakova ,&nbsp;P.M. Korusenko","doi":"10.1016/j.radphyschem.2026.113638","DOIUrl":"10.1016/j.radphyschem.2026.113638","url":null,"abstract":"<div><div>The Ag–CeO<sub>2</sub> nanocomposite (1.3 at. % Ag) with a specific surface area (126.5 m<sup>2</sup>/g), large pore volume (0.11 cm<sup>3</sup>/g) and relatively large Ag nanoparticles (51 ± 3 nm) was obtained using electron beams with different electron energies (from 40 to 500 keV) and investigated for the catalytic oxidation of the popular dye methyl violet (MV). Silver nitrate was used as a precursor. The deposition of Ag nanoparticles was carried out on CeO<sub>2</sub> nanoparticles of 3–5 nm in size, previously obtained by pulsed electron beam evaporation (PEBE) in a vacuum. According to X-ray diffraction and elemental analysis using X-ray photoemission spectroscopy, there were no parasitic impurities in the synthesized product. The composite contained two cubic phases: CeO<sub>2</sub> and Ag. TEM micrographs depicted the formation of agglomerated non-symmetrical NPs in form of 3D spatial nanostructures in the form of “clouds”. The “clouds” were constructed from CeO<sub>2</sub> nanoparticles, smaller than 5 nm in size, which were coated with scatterings of individual and chain spherical Ag nanoparticles, ranging in size from 10 to 200 nm%. EDX spectra confirmed the presence of the main elements in the composite. XPS analysis showed that the composite contained only non-stoichiometric cerium dioxide (CeO<sub>1.8</sub>) with Ag<sup>0</sup> NPs on the surface of the oxide NPs. The deposition of Ag nanoparticles on CeO<sub>2</sub> nanoparticles led to an increase in the photocatalytic activity of the latter by 23 %. The stability of CeO<sub>2</sub> aqueous suspensions was studied using Darvan-CN and sodium citrate dispersants.</div></div>","PeriodicalId":20861,"journal":{"name":"Radiation Physics and Chemistry","volume":"242 ","pages":"Article 113638"},"PeriodicalIF":2.8,"publicationDate":"2026-01-17","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"145995415","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":3,"RegionCategory":"物理与天体物理","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
An insight into radiolytic degradation of Procion dye MX-8G: A pulse radiolysis investigation 对Procion染料MX-8G辐射降解的深入研究:脉冲辐射分解研究
IF 2.8 3区 物理与天体物理 Q3 CHEMISTRY, PHYSICAL Pub Date : 2026-01-17 DOI: 10.1016/j.radphyschem.2026.113636
Sirisha Majji , M.C. Rath , Y.K. Bhardwaj
The radical-mediated degradation of the reactive azo dye Procion MX-8G (PMX-8G), a widely used persistent textile dye, in aqueous solution was investigated using a 7 MeV linear electron accelerator and pulse radiolysis. Electron beam (EB) irradiation at an absorbed dose of 10 kGy resulted in near-complete (>99 %) decolorization for 0.1 mM PMX-8G solution, as evidenced by the decrease in the absorption maximum at λmax ∼416 nm. Under controlled conditions, oxidative pathways were more effective than reductive conditions causing higher degradation. Transient absorption spectra obtained under N2O saturated condition, revealed the formation of short-lived intermediates with absorption bands near ∼350 and ∼580 nm and a bleach signal around ∼420 nm. The OH reaction rate constant with PMX-8G was 2.5 ± 0.2 x 1010 dm3mol−1s−1. Reaction with hydrated electrons (eaq ) produced an anionic intermediate with an absorption peak at ∼500 nm, and the second-order rate constant for the reaction was 1.5 ± 0.2 × 1010 dm3mol−1s−1. The degradation studies carried out in the presence of sodium carbonate (representative of dye-fixing conditions), substantially inhibited degradation, increasing the required dose nearly threefold, for same extent of decolorization, whereas the presence of chloride caused only minor inhibition, reducing 0.15 mM PMX-8G degradation from ∼98 % to ∼92 % at 5 kGy. HRMS product analysis of fragmented dye confirmed that PMX-8G undergoes radiolytic degradation via oxidative and reductive pathways. These results demonstrate the potential of electron-beam treatment as a clean, chemical free approach for treating saline and chemically complex textile effluents.
采用7 MeV线性电子加速器和脉冲辐射解法研究了活性偶氮染料MX-8G (PMX-8G)在水溶液中的自由基降解。吸收剂量为10 kGy的电子束(EB)辐照导致0.1 mM PMX-8G溶液几乎完全(> 99%)脱色,在λmax ~ 416 nm处吸收最大值下降。在受控条件下,氧化途径比还原途径更有效,降解率更高。在N2O饱和条件下获得的瞬态吸收光谱显示,在~ 350和~ 580 nm附近形成了短寿命中间体,在~ 420 nm附近形成了漂白信号。•OH与PMX-8G的反应速率常数为2.5±0.2 × 1010dm3mol−1s−1。与水合电子(eaq−)反应产生阴离子中间体,其吸收峰在~ 500 nm处,反应的二级速率常数为1.5±0.2 × 1010 dm3mol−1s−1。在碳酸钠(染料固定条件的代表)存在下进行的降解研究,基本上抑制了降解,将所需剂量增加近三倍,达到相同程度的脱色,而氯的存在只引起轻微的抑制,在5 kGy下将0.15 mM PMX-8G的降解从~ 98%降低到~ 92%。碎片化染料HRMS产物分析证实PMX-8G通过氧化和还原途径进行辐射降解。这些结果表明电子束处理作为一种清洁、无化学物质的方法处理含盐和化学物质复杂的纺织废水的潜力。
{"title":"An insight into radiolytic degradation of Procion dye MX-8G: A pulse radiolysis investigation","authors":"Sirisha Majji ,&nbsp;M.C. Rath ,&nbsp;Y.K. Bhardwaj","doi":"10.1016/j.radphyschem.2026.113636","DOIUrl":"10.1016/j.radphyschem.2026.113636","url":null,"abstract":"<div><div>The radical-mediated degradation of the reactive azo dye Procion MX-8G (PMX-8G), a widely used persistent textile dye, in aqueous solution was investigated using a 7 MeV linear electron accelerator and pulse radiolysis. Electron beam (EB) irradiation at an absorbed dose of 10 kGy resulted in near-complete (&gt;99 %) decolorization for 0.1 mM PMX-8G solution, as evidenced by the decrease in the absorption maximum at <em>λ<sub>max</sub></em> ∼416 nm. Under controlled conditions, oxidative pathways were more effective than reductive conditions causing higher degradation. Transient absorption spectra obtained under N<sub>2</sub>O saturated condition, revealed the formation of short-lived intermediates with absorption bands near ∼350 and ∼580 nm and a bleach signal around ∼420 nm. The <sup>•</sup>OH reaction rate constant with PMX-8G was 2.5 ± 0.2 x 10<sup>10</sup> dm<sup>3</sup>mol<sup>−1</sup>s<sup>−1</sup>. Reaction with hydrated electrons (e<sub>aq</sub> <sup>−</sup>) produced an anionic intermediate with an absorption peak at ∼500 nm, and the second-order rate constant for the reaction was 1.5 ± 0.2 × 10<sup>10</sup> dm<sup>3</sup>mol<sup>−1</sup>s<sup>−1</sup>. The degradation studies carried out in the presence of sodium carbonate (representative of dye-fixing conditions), substantially inhibited degradation, increasing the required dose nearly threefold, for same extent of decolorization, whereas the presence of chloride caused only minor inhibition, reducing 0.15 mM PMX-8G degradation from ∼98 % to ∼92 % at 5 kGy. HRMS product analysis of fragmented dye confirmed that PMX-8G undergoes radiolytic degradation via oxidative and reductive pathways. These results demonstrate the potential of electron-beam treatment as a clean, chemical free approach for treating saline and chemically complex textile effluents.</div></div>","PeriodicalId":20861,"journal":{"name":"Radiation Physics and Chemistry","volume":"242 ","pages":"Article 113636"},"PeriodicalIF":2.8,"publicationDate":"2026-01-17","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"145995417","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":3,"RegionCategory":"物理与天体物理","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Study of nonlinear optical crystals of l-nitroarginine perchlorate and l-nitroarginine tetrafluoroborate 高氯酸l -硝基精氨酸和四氟硼酸l -硝基精氨酸非线性光学晶体的研究
IF 2.8 3区 物理与天体物理 Q3 CHEMISTRY, PHYSICAL Pub Date : 2026-01-16 DOI: 10.1016/j.radphyschem.2026.113649
Ruzan Sukiasyan , Ruben Apreyan , Kyrill Suponitsky , Astghik Danghyan , Nelli Gharibyan , Liana Bezhanova , Armen Atanesyan
Nonlinear optical (NLO) crystals such as l-nitroarginine perchlorate (L-NNA·HClO4) and l-nitroarginine tetrafluoroborate (L-NNA·HBF4) were investigated. The crystal and molecular structures of both compounds were determined by single-crystal X-ray diffraction at 100 K. Both crystals crystallize in the monoclinic, non-centrosymmetric space group P21 with Z = 2 and are isostructural, similar to l-arginine salts analogues. Nonlinear optical measurements performed using the modified Kurtz–Perry powder technique demonstrate that both crystals exhibit strong second-harmonic generation (SHG) activity, several times higher than that of known l-arginine salts analogues. The SHG efficiency of L-NNA·HClO4 is approximately 1.5 times higher than that of L-NNA·HBF4. These results demonstrate the potential of l-nitroarginine-based salts as promising semi-organic NLO materials.
研究了高氯酸l-硝基精氨酸(L-NNA·HClO4)和四氟硼酸l-硝基精氨酸(L-NNA·HBF4)等非线性光学晶体。用100 K单晶x射线衍射测定了两种化合物的晶体结构和分子结构。两种晶体均在Z = 2的单斜、非中心对称空间群P21中结晶,并且是同结构的,类似于l-精氨酸盐类似物。使用改进的Kurtz-Perry粉末技术进行的非线性光学测量表明,这两种晶体都表现出强烈的二次谐波产生(SHG)活性,比已知的l-精氨酸盐类似物高几倍。L-NNA·HClO4的SHG效率约为L-NNA·HBF4的1.5倍。这些结果证明了l-硝基精氨酸盐作为有前途的半有机NLO材料的潜力。
{"title":"Study of nonlinear optical crystals of l-nitroarginine perchlorate and l-nitroarginine tetrafluoroborate","authors":"Ruzan Sukiasyan ,&nbsp;Ruben Apreyan ,&nbsp;Kyrill Suponitsky ,&nbsp;Astghik Danghyan ,&nbsp;Nelli Gharibyan ,&nbsp;Liana Bezhanova ,&nbsp;Armen Atanesyan","doi":"10.1016/j.radphyschem.2026.113649","DOIUrl":"10.1016/j.radphyschem.2026.113649","url":null,"abstract":"<div><div>Nonlinear optical (NLO) crystals such as <span>l</span>-nitroarginine perchlorate (L-NNA·HClO<sub>4</sub>) and <span>l</span>-nitroarginine tetrafluoroborate (L-NNA·HBF<sub>4</sub>) were investigated. The crystal and molecular structures of both compounds were determined by single-crystal X-ray diffraction at 100 K. Both crystals crystallize in the monoclinic, non-centrosymmetric space group P2<sub>1</sub> with Z = 2 and are isostructural, similar to <span>l</span>-arginine salts analogues. Nonlinear optical measurements performed using the modified Kurtz–Perry powder technique demonstrate that both crystals exhibit strong second-harmonic generation (SHG) activity, several times higher than that of known <span>l</span>-arginine salts analogues. The SHG efficiency of L-NNA·HClO<sub>4</sub> is approximately 1.5 times higher than that of L-NNA·HBF<sub>4</sub>. These results demonstrate the potential of <span>l</span>-nitroarginine-based salts as promising semi-organic NLO materials.</div></div>","PeriodicalId":20861,"journal":{"name":"Radiation Physics and Chemistry","volume":"242 ","pages":"Article 113649"},"PeriodicalIF":2.8,"publicationDate":"2026-01-16","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"145995422","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":3,"RegionCategory":"物理与天体物理","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Functional evaluation of electron-beam irradiated honey sourced from diverse floral ecosystems: A sustainable route for preservation with enhanced quality 来自不同花卉生态系统的电子束辐照蜂蜜的功能评价:提高质量的可持续保存途径
IF 2.8 3区 物理与天体物理 Q3 CHEMISTRY, PHYSICAL Pub Date : 2026-01-16 DOI: 10.1016/j.radphyschem.2026.113639
Ejazul Haque M. Malik, Asma N. Khan, Sabrina A. Shaikh, Ashok K. Pandey, Hemlata K. Bagla
Electron beam irradiation (EBI) was applied to six varietal honey samples obtained from the Western Ghats, India, at doses of 10–40 kGy using a 10 MeV accelerator to assess effects on biochemical composition and functional properties. Pissa honey exhibited the highest baseline phenolic and flavonoid contents and antioxidant activity. The fructose-to-glucose ratio and sugar carbon patterns remained unchanged following irradiation, indicating preservation of the carbohydrate matrix and sensory-relevant parameters. Dose-dependent increases were observed in hydroxymethylfurfural (HMF), total phenolic content (TPC), and total flavonoid content (TFC), with HMF remaining within acceptable regulatory limits and TPC/TFC increasing up to 30 kGy. Correspondingly, radical scavenging activity increased and plateaued beyond 30 kGy. Microbial loads were reduced at 10 kGy, while complete sterilization was achieved at 30 kGy, with no further functional advantage at 40 kGy. Based on these outcomes, 30 kGy was identified as the optimal dose balancing microbial safety, biochemical enrichment, and material stability. The findings support the feasibility of EBI as a non-thermal decontamination method for honey, with relevance to current food safety and irradiation standardization efforts. Identifying an optimal dose is pertinent to policy discussions surrounding Codex Alimentarius and FAO/IAEA frameworks for food irradiation, labeling, and dose harmonization. Such data may inform regulatory consideration of honey as a candidate for irradiated food categories, particularly in medicinal, nutraceutical, and clinical nutrition applications where sterility and biochemical integrity are required. The study also contributes to sustainability-oriented processing approaches that minimize thermal degradation and support extended shelf-life without compromising functional attributes.
采用电子束辐照(EBI)对印度西高止山脉的6个品种的蜂蜜样品进行辐照,辐照剂量为10 - 40 kGy,使用10 MeV加速器评估其对生物化学组成和功能特性的影响。蜜的酚类、类黄酮含量和抗氧化活性最高。辐照后,果糖与葡萄糖的比例和糖碳模式保持不变,表明碳水化合物基质和感官相关参数得到了保存。羟甲基糠醛(HMF)、总酚含量(TPC)和总黄酮含量(TFC)呈剂量依赖性增加,羟甲基糠醛(HMF)保持在可接受的监管范围内,TPC/TFC增加至30 kGy。相应的,自由基清除活性在30 kGy以上增加并趋于稳定。微生物负荷在10 kGy时减少,而在30 kGy时实现完全灭菌,在40 kGy时没有进一步的功能优势。基于这些结果,30 kGy被确定为平衡微生物安全性、生化富集和材料稳定性的最佳剂量。研究结果支持EBI作为蜂蜜非热净化方法的可行性,与当前食品安全和辐照标准化工作相关。确定最佳剂量与围绕食品法典委员会和粮农组织/原子能机构食品辐照、标签和剂量协调框架的政策讨论有关。这些数据可能会告知监管机构考虑将蜂蜜作为辐照食品类别的候选物,特别是在需要无菌性和生化完整性的医药、营养和临床营养应用中。该研究还有助于以可持续发展为导向的加工方法,最大限度地减少热降解,并在不影响功能属性的情况下延长保质期。
{"title":"Functional evaluation of electron-beam irradiated honey sourced from diverse floral ecosystems: A sustainable route for preservation with enhanced quality","authors":"Ejazul Haque M. Malik,&nbsp;Asma N. Khan,&nbsp;Sabrina A. Shaikh,&nbsp;Ashok K. Pandey,&nbsp;Hemlata K. Bagla","doi":"10.1016/j.radphyschem.2026.113639","DOIUrl":"10.1016/j.radphyschem.2026.113639","url":null,"abstract":"<div><div>Electron beam irradiation (EBI) was applied to six varietal honey samples obtained from the Western Ghats, India, at doses of 10–40 kGy using a 10 MeV accelerator to assess effects on biochemical composition and functional properties. Pissa honey exhibited the highest baseline phenolic and flavonoid contents and antioxidant activity. The fructose-to-glucose ratio and sugar carbon patterns remained unchanged following irradiation, indicating preservation of the carbohydrate matrix and sensory-relevant parameters. Dose-dependent increases were observed in hydroxymethylfurfural (HMF), total phenolic content (TPC), and total flavonoid content (TFC), with HMF remaining within acceptable regulatory limits and TPC/TFC increasing up to 30 kGy. Correspondingly, radical scavenging activity increased and plateaued beyond 30 kGy. Microbial loads were reduced at 10 kGy, while complete sterilization was achieved at 30 kGy, with no further functional advantage at 40 kGy. Based on these outcomes, 30 kGy was identified as the optimal dose balancing microbial safety, biochemical enrichment, and material stability. The findings support the feasibility of EBI as a non-thermal decontamination method for honey, with relevance to current food safety and irradiation standardization efforts. Identifying an optimal dose is pertinent to policy discussions surrounding Codex Alimentarius and FAO/IAEA frameworks for food irradiation, labeling, and dose harmonization. Such data may inform regulatory consideration of honey as a candidate for irradiated food categories, particularly in medicinal, nutraceutical, and clinical nutrition applications where sterility and biochemical integrity are required. The study also contributes to sustainability-oriented processing approaches that minimize thermal degradation and support extended shelf-life without compromising functional attributes.</div></div>","PeriodicalId":20861,"journal":{"name":"Radiation Physics and Chemistry","volume":"242 ","pages":"Article 113639"},"PeriodicalIF":2.8,"publicationDate":"2026-01-16","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"145978447","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":3,"RegionCategory":"物理与天体物理","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Data-driven refinement of microscopic γ-ray strength functions for Nd isotopes Nd同位素微观γ射线强度函数的数据驱动改进
IF 2.8 3区 物理与天体物理 Q3 CHEMISTRY, PHYSICAL Pub Date : 2026-01-16 DOI: 10.1016/j.radphyschem.2026.113641
M. Sepiani , M.N. Nasrabadi
The γ-ray strength function (γSF) is one of the most important components of photonuclear and radiative nuclear reaction mechanisms, describing the probability of the gamma-ray emission or absorption. Microscopic models of γSF offer a more fundamental description compared to phenomenological approaches, they cannot be flexibly adjusted to experimental data. To address this problem, a correction method for microscopic γSFs using some adjustable parameters has been implemented in the nuclear reaction codes. This work determines the optimal values of these parameters for microscopic Gogny HFB + QRPA γSF model for neodymium (Nd) isotopes by analyzing existing experimental γSF data for investigating the photonuclear reactions. The results demonstrate that by applying these adjustable parameters, the predictive accuracy of microscopic model for these reactions can be significantly improved. This improvement has important implications for various fields in nuclear physics and technology.
γ射线强度函数(γSF)是光核和辐射核反应机制中最重要的组成部分之一,描述了射线发射或吸收的概率。与现象学方法相比,γ - sf的微观模型提供了更基本的描述,它们不能灵活地调整到实验数据。为了解决这一问题,在核反应代码中实现了一种利用一些可调参数对微观γ - sfs进行校正的方法。本工作通过分析现有的用于研究光核反应的γSF实验数据,确定了这些参数的最优值用于钕同位素的微观Gogny HFB + QRPA γSF模型。结果表明,应用这些可调参数,可以显著提高微观模型对这些反应的预测精度。这一改进对核物理和技术的各个领域具有重要意义。
{"title":"Data-driven refinement of microscopic γ-ray strength functions for Nd isotopes","authors":"M. Sepiani ,&nbsp;M.N. Nasrabadi","doi":"10.1016/j.radphyschem.2026.113641","DOIUrl":"10.1016/j.radphyschem.2026.113641","url":null,"abstract":"<div><div>The γ-ray strength function (γSF) is one of the most important components of photonuclear and radiative nuclear reaction mechanisms, describing the probability of the gamma-ray emission or absorption. Microscopic models of γSF offer a more fundamental description compared to phenomenological approaches, they cannot be flexibly adjusted to experimental data. To address this problem, a correction method for microscopic γSFs using some adjustable parameters has been implemented in the nuclear reaction codes. This work determines the optimal values of these parameters for microscopic Gogny HFB + QRPA γSF model for neodymium (Nd) isotopes by analyzing existing experimental γSF data for investigating the photonuclear reactions. The results demonstrate that by applying these adjustable parameters, the predictive accuracy of microscopic model for these reactions can be significantly improved. This improvement has important implications for various fields in nuclear physics and technology.</div></div>","PeriodicalId":20861,"journal":{"name":"Radiation Physics and Chemistry","volume":"243 ","pages":"Article 113641"},"PeriodicalIF":2.8,"publicationDate":"2026-01-16","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"145995421","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":3,"RegionCategory":"物理与天体物理","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
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Radiation Physics and Chemistry
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