Results in Materials最新文献_第4页

General prediction of transport and thermodynamic properties of deep eutectic solvents based on choline chloride using machine learning 基于氯化胆碱的深共晶溶剂输运和热力学性质的机器学习一般预测

Results in Materials Pub Date : 2025-05-29 DOI: 10.1016/j.rinma.2025.100730

Farshid Zargari, Alireza Nowroozi

{"title":"General prediction of transport and thermodynamic properties of deep eutectic solvents based on choline chloride using machine learning","authors":"Farshid Zargari, Alireza Nowroozi","doi":"10.1016/j.rinma.2025.100730","DOIUrl":"10.1016/j.rinma.2025.100730","url":null,"abstract":"<div><div>This study delves into the potential of machine learning (ML) to predict the properties of choline chloride-based deep eutectic solvents (DESs), focusing on density, viscosity, and ionic conductivity. Utilizing a dataset derived from an extensive review of scientific literature, we applied a variety of ML models, including tree-based algorithms and neural networks, to establish correlations between DES features and their physical properties. Our findings demonstrate that models like Random Forest, XGBoost, LightGBM, and Stacked Models excel in predictive accuracy, particularly for density and viscosity, as evidenced by high R2 and Pearson correlation values. Our exploration into ionic conductivity revealed that despite initial assumptions, the size of the dataset did not limit the predictive capability. Learning curve analysis illustrated that models like LightGBM performed consistently well across varying dataset sizes, maintaining accuracy in their predictions. Notably, the Stacked Models emerged as the most effective, suggesting the benefit of combining different ML approaches for such predictions. The study also employed SHAP analysis to discern the impact of specific molecular features on the predictive outcomes, providing deeper insights into DES behavior. In essence, our results confirm that ML can be a powerful tool in the predictive modeling of DES properties, which has significant implications for the design and optimization of these solvents in various industrial applications.</div></div>","PeriodicalId":101087,"journal":{"name":"Results in Materials","volume":"27 ","pages":"Article 100730"},"PeriodicalIF":0.0,"publicationDate":"2025-05-29","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"144190031","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}

引用次数: 0

Microstructure, phase composition, and oxidation resistance of alloys of Nb-Ti-Al system produced by electron beam melting and zone melting 电子束熔炼和区域熔炼Nb-Ti-Al系合金的显微组织、相组成和抗氧化性

Results in Materials Pub Date : 2025-05-29 DOI: 10.1016/j.rinma.2025.100729

Iryna Trosnikova , Anatolii Minitskyi , Ievgen Byba , Dmytro Vedel , Мaksym Barabash

引用次数: 0

Optimization of 3D printing parameters for carbon fiber reinforced polymer (CFRP) material: Impact and hardness analysis using Taguchi method 碳纤维增强聚合物（CFRP）材料3D打印参数优化：使用田口法进行冲击和硬度分析

Results in Materials Pub Date : 2025-05-28 DOI: 10.1016/j.rinma.2025.100727

Wahyu Dwi Lestari , Abdi Satryo Mukti , Ndaru Adyono , I Gede Susrama Mas Diyasa , Ni Ketut Sari , Wahyu Caesarendra , Chatarina Sari , Nur Rachmat , Iwan Budiwan

{"title":"Optimization of 3D printing parameters for carbon fiber reinforced polymer (CFRP) material: Impact and hardness analysis using Taguchi method","authors":"Wahyu Dwi Lestari , Abdi Satryo Mukti , Ndaru Adyono , I Gede Susrama Mas Diyasa , Ni Ketut Sari , Wahyu Caesarendra , Chatarina Sari , Nur Rachmat , Iwan Budiwan","doi":"10.1016/j.rinma.2025.100727","DOIUrl":"10.1016/j.rinma.2025.100727","url":null,"abstract":"<div><div>Carbon fiber-reinforced polymers (CFRP) have gained significant attention due to their excellent mechanical properties. However, optimizing 3D printing parameters remains a challenge in achieving enhanced material performance. In this study, a commercial CFRP filament with a polymeric matrix composed of polylactic acid (PLA) was used. The main objective was to analyze the impact strength and hardness of printed samples using the Taguchi method. The factors utilized were nozzle temperature, infill density, printing speed, layer thickness, infill pattern, and orientation. Confirmation tests were conducted to confirm the optimal parameter setting by comparing the experimental result with calculated values. The confirmation test validated that the optimal parameters yielded a Shore D hardness value of 74.8132 and impact strength of 1.261 J. ANOVA results indicated that the layer thickness (38.23 %) and infill density (25.01 %) significantly affected the hardness, whereas infill density (65.57 %) and layer thickness (18.31 %) were the predominant factors affecting impact strength. The findings confirm that Taguchi technique effectively optimizes 3D printing parameters of CFRP materials for improved mechanical properties and manufacturing efficiency. Future research should be directed towards hybrid post-processing techniques, fatigue and wear resistance tests, internal structure optimization, and environmental tests for further performance improvement of CFRP in industries.</div></div>","PeriodicalId":101087,"journal":{"name":"Results in Materials","volume":"27 ","pages":"Article 100727"},"PeriodicalIF":0.0,"publicationDate":"2025-05-28","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"144242512","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}

引用次数: 0

Study the effect of processing parameters on friction stir welding of AA5083 aluminum alloy reinforced with Al-SiC matrix 研究了工艺参数对Al-SiC基增强AA5083铝合金搅拌摩擦焊接的影响

Results in Materials Pub Date : 2025-05-28 DOI: 10.1016/j.rinma.2025.100731

Noha M. abdeltawab , Mohamed Elshazly , Ahmed Y. Shash , M. El-Sherbiny

{"title":"Study the effect of processing parameters on friction stir welding of AA5083 aluminum alloy reinforced with Al-SiC matrix","authors":"Noha M. abdeltawab , Mohamed Elshazly , Ahmed Y. Shash , M. El-Sherbiny","doi":"10.1016/j.rinma.2025.100731","DOIUrl":"10.1016/j.rinma.2025.100731","url":null,"abstract":"<div><div>Improving the friction stir welding of AA5083 has been documented in recent applications in corrosive mediums like shipbuilding and chemical storage vessels. This article studies the effect of reinforcing the AA5083 friction stir welding joint with aluminum-silicon carbide matrix particles synthesized by ball milling with different silicon carbide weight ratios. As well as the effect of welding process parameters (transverse speed and rotational speed) on the tensile strength, hardness, and corrosion properties of the reinforced joint was investigated. Results show that as the silicon carbide weight ratio in the reinforcement matrix increases the joint strength and corrosion resistance increase, while corrosion weight loss decreases with an increase in transverse speed. Microstructure and hardness investigation show that the rotational speed of 800 rpm was the most efficient in mixing reinforcement in the joint so it has the higher strength and lower corrosion weight loss at fixing the other parameters, it shows also the transverse speed of 40 mm/min give the welding the adequate amount of heat input to maintain the interconnection between grains that have the highest strength in fixing the other parameters.</div></div>","PeriodicalId":101087,"journal":{"name":"Results in Materials","volume":"27 ","pages":"Article 100731"},"PeriodicalIF":0.0,"publicationDate":"2025-05-28","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"144196464","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}

引用次数: 0

Facile preparation of nickel phosphide/multi-walled carbon nanotube films for high-performance Li–O2 batteries 高性能锂氧电池用磷化镍/多壁碳纳米管薄膜的简易制备

Results in Materials Pub Date : 2025-05-19 DOI: 10.1016/j.rinma.2025.100726

Younggwon Cho, Kichang Hong, Inhan Kang, Jungwon Kang

引用次数: 0

Synthesis of tobermorite 11 Å during the formation of autoclaved aerated concrete with the addition of diatomite 掺加硅藻土的蒸压加气混凝土形成过程中托贝莫来石11的合成Å

Results in Materials Pub Date : 2025-05-15 DOI: 10.1016/j.rinma.2025.100725

I. Alejandra Corro-Escorcia , Juan Hernández-Ávila , Eduardo Cerecedo-Sáenz , F.R. Barrientos-Hernández , Montserrat Cruz-Hernández , Norman Toro , Edelmira Gálvez , M.P. Gutiérrez-Amador , Eleazar Salinas-Rodríguez

{"title":"Synthesis of tobermorite 11 Å during the formation of autoclaved aerated concrete with the addition of diatomite","authors":"I. Alejandra Corro-Escorcia , Juan Hernández-Ávila , Eduardo Cerecedo-Sáenz , F.R. Barrientos-Hernández , Montserrat Cruz-Hernández , Norman Toro , Edelmira Gálvez , M.P. Gutiérrez-Amador , Eleazar Salinas-Rodríguez","doi":"10.1016/j.rinma.2025.100725","DOIUrl":"10.1016/j.rinma.2025.100725","url":null,"abstract":"<div><div>The fundamental structure of an autoclaved aerated concrete, is closely linked with the formation of tobermorite, which is called the heart of concrete and directly affects its mechanical properties. However the presence of only tobermorite 11 Å (instead that of 9 or 14 Å), is more desirable. For this reason, it is important to study what are the conditions during the synthesis of concrete, that can favor the formation of this phase. In this paper, the effect of natural diatomite addition in conjunction with the evaluation of two different calcium-silicon oxides ratio during the synthesis of an autoclaved aerated concrete, were studied. The main objective was to promote the tobermorite 11 Å formation, which can improve the compressive strength of that concrete. The synthesis was carried out testing two CaO/SiO<sub>2</sub> ratios (0.5 and 0.8) with different percentages of diatomite (0, 0.5, 0.10, 0.15, 0.20 and 0.25 %). It was found that with an oxide ratio of 0.5 and 0.15 % of diatomite, the presence of tobermorite 9 Å increased from 29 to 33 % and the concrete reached a maximum value compressive strength of 4.66 MPa. On the other hand, for an oxide ratio of 0.8 and 0.20 % of diatomite, it was found the presence of only tobermorite 11 Å (which corresponds to 38 %), getting so a maximum value of 4.73 MPa. In both previous cases, it was found an increase of 16.5 and 18.25 % respectively, in comparison with the 4 MPa necessary for this type of materials, to be considered for structural applications. According to the above, the oxide ratio of 0.8, in conjunction with addition of diatomite, can promote the formation of tobermorite 11 Å mainly, which also improved the compressive strength values.</div></div>","PeriodicalId":101087,"journal":{"name":"Results in Materials","volume":"26 ","pages":"Article 100725"},"PeriodicalIF":0.0,"publicationDate":"2025-05-15","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"144084572","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}

引用次数: 0

Investigating the correlation between sand particle size and ultrasonic properties of mortar: A comprehensive analysis using ultrasonic techniques 研究砂粒度与砂浆超声性能的关系：超声技术的综合分析

Results in Materials Pub Date : 2025-05-14 DOI: 10.1016/j.rinma.2025.100717

Hicham Mesbah , Hicham Lotfi , Mounir Tafkirte , Hicham Banouni , Mohamed Ettahiri , Bouazza Faiz

{"title":"Investigating the correlation between sand particle size and ultrasonic properties of mortar: A comprehensive analysis using ultrasonic techniques","authors":"Hicham Mesbah , Hicham Lotfi , Mounir Tafkirte , Hicham Banouni , Mohamed Ettahiri , Bouazza Faiz","doi":"10.1016/j.rinma.2025.100717","DOIUrl":"10.1016/j.rinma.2025.100717","url":null,"abstract":"<div><div>The accurate characterization of construction materials is crucial for ensuring their durability and performance in the construction industry. This study focuses on the non-destructive characterization of mortar using ultrasonic techniques to investigate the impact of sand grain size on ultrasonic properties. Using 1 MHz transducers, we observed significant non-linear variations in ultrasonic velocity, with a decrease to 3100 m/s at a particle size of 0.3 mm, followed by an increase to 3700 m/s as the grain size approached 0.7 mm. These results demonstrate a strong correlation between sand grain size and the ultrasonic properties of mortar, highlighting the influence of particle size on parameters such as transmission coefficient and acoustic impedance. By selecting appropriate sand grain sizes, the risk of cracking and degradation in mortar can be minimized, leading to improved durability and structural integrity. This study contributes actionable insights for optimizing mortar compositions, paving the way for enhanced construction materials.</div></div>","PeriodicalId":101087,"journal":{"name":"Results in Materials","volume":"26 ","pages":"Article 100717"},"PeriodicalIF":0.0,"publicationDate":"2025-05-14","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"144072296","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}

引用次数: 0

Determining the quality of imprinted polymers using diverse feature selections methods, Ada Boost and Gradient boosting algorithms 使用不同的特征选择方法，Ada Boost和梯度增强算法来确定印迹聚合物的质量

Results in Materials Pub Date : 2025-05-12 DOI: 10.1016/j.rinma.2025.100722

Bita Yarahmadi , Seyed Majid Hashemianzadeh

{"title":"Determining the quality of imprinted polymers using diverse feature selections methods, Ada Boost and Gradient boosting algorithms","authors":"Bita Yarahmadi , Seyed Majid Hashemianzadeh","doi":"10.1016/j.rinma.2025.100722","DOIUrl":"10.1016/j.rinma.2025.100722","url":null,"abstract":"<div><div>The use of polymer informatics is an appropriate solution to overcome the problems of optimizing the synthesis conditions of polymers, which has attracted the attention of many researchers. The aim of this study is to develop a comprehensive model to predict the imprinting factor (IF) value for different template molecules. Therefore, molecularly imprinted polymers (MIPs) were synthesized for various template molecules, their IF values were calculated, and then a data set table was prepared. By utilizing the Ada Boost algorithm, Gradient boosting algorithm and various feature selection methods such as forward selection, mutual information, correlation statistics, chi-square and Recursive Feature Elimination (RFE), an accurate model was created to predict IF. The results showed that using the Ada Boost algorithm and the RFE feature selection method, improved modeling accuracy achieving a maximum R<sup>2</sup> score (R<sup>2</sup> = 0.937, Adjusted R<sup>2</sup> = 0.936) and minimum errors (MAE = 0.915, MSE = 7.052). The accuracy of the models obtained using the gradient boosting algorithm was lower compared to the Ada Boost algorithm, and the maximum accuracy of the model was obtained using the mutual information method. This paper provides specific quantitative insights into how each feature selection method affected prediction performance, supported by relevant metrics.</div></div>","PeriodicalId":101087,"journal":{"name":"Results in Materials","volume":"27 ","pages":"Article 100722"},"PeriodicalIF":0.0,"publicationDate":"2025-05-12","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"144212423","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}

引用次数: 0

Characterizations of nickel-rich NMC lithium-ion battery cathode with varying transition metal ratios synthesized via hydroxide co-precipitation 氢氧共沉淀法合成不同过渡金属比的富镍NMC锂离子电池正极的表征

Results in Materials Pub Date : 2025-05-07 DOI: 10.1016/j.rinma.2025.100724

Handi Muhtadi , S. Suwarno , Achmad Subhan

{"title":"Characterizations of nickel-rich NMC lithium-ion battery cathode with varying transition metal ratios synthesized via hydroxide co-precipitation","authors":"Handi Muhtadi , S. Suwarno , Achmad Subhan","doi":"10.1016/j.rinma.2025.100724","DOIUrl":"10.1016/j.rinma.2025.100724","url":null,"abstract":"<div><div>Cobalt content in Li-ion battery cathodes has become a major concern due to its price volatility and the limited availability of sources. Low-cobalt, Ni-rich active materials are promising candidates for next-generation cathodes because of their high capacities, and many proposed processing methods for these materials can further reduce both cost and environmental impact. However, the resulting lattice changes can lead to structural degradation and capacity fading. In this study, we report the effects of cobalt content on the crystal structure and morphology of nickel-rich Li[NixCoyMnz]O<sub>2</sub> (where x ≥ 0.8; x + y + z = 1) cathode materials synthesized using the hydroxide-route co-precipitation method. The synthesized cathodes were characterized through Particle Size Distribution (PSD), scanning electron microscope-energy dispersive spectroscopy (SEM-EDS), and X-ray diffraction (XRD). Their electrochemical properties were examined using electrochemical impedance spectroscopy (EIS) and cyclic voltammetry. Results indicate that slight variations in cobalt content did affect the synthesized cathode slightly, highlighting the potential for low-cobalt electrodes.</div></div>","PeriodicalId":101087,"journal":{"name":"Results in Materials","volume":"26 ","pages":"Article 100724"},"PeriodicalIF":0.0,"publicationDate":"2025-05-07","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"143935172","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}

引用次数: 0

Sustainable synthesis and characterization of silver nanoparticles through Juncus acutus flowers and evaluation of their ability to detect NO2 and NH3 gases 银花纳米粒子的可持续合成、表征及其对NO2和NH3气体的检测能力评价

Results in Materials Pub Date : 2025-05-07 DOI: 10.1016/j.rinma.2025.100723

Mohammed B. AbdulWahid , Osama H. Abdullah , Othman Hamad Farhan , Maytham Imad Ahmed , Ahmed Mishaal Mohammed , Yousif Hendi Khalaf

{"title":"Sustainable synthesis and characterization of silver nanoparticles through Juncus acutus flowers and evaluation of their ability to detect NO2 and NH3 gases","authors":"Mohammed B. AbdulWahid , Osama H. Abdullah , Othman Hamad Farhan , Maytham Imad Ahmed , Ahmed Mishaal Mohammed , Yousif Hendi Khalaf","doi":"10.1016/j.rinma.2025.100723","DOIUrl":"10.1016/j.rinma.2025.100723","url":null,"abstract":"<div><div>In this effort, the Juncus acutus plant's flowers were used to create silver nanoparticles (AgNPs). Using X-ray diffraction (XRD), field emission scanning electron microscopy (FE-SEM), and energy dispersive X-ray (EDX), the characteristics of the prepared silver nanoparticles were evaluated. The size of the silver nanoparticles was 38.40 nm. At various temperatures and times, the silver nanoparticles were assessed as gas sensors for the gases NO<sub>2</sub> and NH<sub>3</sub>. At 100 °C, the highest sensitivity response to NO<sub>2</sub> gas was 15.09 %. However, in the case of the NH<sub>3</sub> gas, the highest sensitivity response was 25 % at 200 °C. For NO<sub>2</sub>, the sensor displayed the smallest response and recovery times at various temperatures: 19.71s at 300 °C and 33.3s at 100 °C, respectively, and for NH<sub>3</sub> gas, 16.74s at 200 °C and 20.25s at 300 °C, respectively. These outcomes highlight the sensor's exceptional response and recovery abilities.</div></div>","PeriodicalId":101087,"journal":{"name":"Results in Materials","volume":"26 ","pages":"Article 100723"},"PeriodicalIF":0.0,"publicationDate":"2025-05-07","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"143932027","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}

引用次数: 0