jablonkagroup/rise_ai_scientists huggingface dataset:
Authors: Amnah Alalmaie | Hend Faye AL-shahrani | Manar Alqahtani | Zeyad Alshahrani | Shahad Alahmari | Abdullah M. Asiri | Bandar Alqadi | Abdulrahman Alshahrani | Safar A. AlShahrani | Md Habban Akhter
Source: Frontiers in Medical Technology (review, 2025-02-24)
Field: Materials Science — Electronic, Optical and Magnetic Materials

Integrating computational insights in gold nanoparticle-mediated drug delivery: enhancing efficacy and precision Gold nanoparticles (AuNPs) have emerged as a versatile platform in biomedical applications, particularly in drug delivery, cancer therapy, and diagnostics, due to their unique physicochemical properties. This review focuses on the integration of computational methods and artificial intelligence (AI) with nanotechnology to optimize AuNP-based therapies. Computational modeling is essential for understanding the interactions between AuNPs and biological molecules, guiding nanoparticle design for improved targeting, stability, and therapeutic efficacy. Recent advancements, including AI-driven models in precision cancer therapy and the combination of AuNPs with antimicrobial peptides (AMPs) to combat drug-resistant pathogens, are highlighted. The review also discusses challenges such as toxicity, targeting efficiency, and the need for scalable synthesis, alongside the limitations of computational modeling in capturing complex biological environments. Emphasizing the importance of ongoing research and interdisciplinary collaboration, this review underscores the potential of integrating computational insights with AuNP technology to enhance the precision, safety, and effectiveness of therapeutic and diagnostic approaches. Nanotechnology ; Drug delivery ; Computer science ; Cancer therapy ; Colloidal gold ; Biochemical engineering ; Nanoparticle ; Engineering ; Materials science ; Cancer ; Medicine Gold and Silver Nanoparticles Synthesis and Applications ; Computational Drug Discovery Methods
Authors: Linh Chi Tran | Xiao Su | Huynh H. Nguyen | Ly Bao Truc La | Philip Adu | Qiong Jia | Ivan Lee | Hsu‐Chiang Kuan | Xianhu Liu | Jun Ma
Source: Advanced Nanocomposites (article, 2025-03-12)
Field: Materials Science — Polymers and Plastics

Advancing polymer nanocomposites through mechanochemical approaches Mechanochemical approaches have recently garnered significant interests in the development of polymer nanocomposites due to their effectiveness, environmental sustainability, scalability and simplicity. Most of previous reviews on this topic focus on either nanomaterial synthesis or specific methods, without fully exploring how these techniques affect the interfacial interactions and thus the morphology and properties of polymer nanocomposites. This review provides a comprehensive analysis of mechanochemical methods, encompassing both established techniques (e.g., ball milling and ultrasonication) and newer approaches (e.g., solid-state shear milling, focused ultrasonication or plasma-assisted mechanochemical mixing). It highlights the benefits, drawbacks and recent innovations of these methods regarding the dispersion of nanofillers within and their compatibility with polymer matrices. This review also provides a future perspective on integrating artificial intelligence and sustainable practices into mechanochemical processes, while proposing solutions to tackle the challenge of broad size distribution of nanofillers. We aim to foster the widespread adoption of mechanochemical processes across diverse fields, from laboratory to industrial scales. Nanocomposite ; Materials science ; Polymer ; Polymer nanocomposite ; Polymer science ; Nanotechnology ; Composite material Polymer Nanocomposites and Properties ; Polymer composites and self-healing ; Conducting polymers and applications
Authors: Mengyao Bian | Xin Yang | Xinyu Han | Kaijie Liu | Xiangguang Yang | Yibo Zhang
Source: Journal of Hazardous Materials (article, 2025-06-27)
Field: Materials Science — Materials Chemistry

Edge-site anchored single-atom Ti on α-MnO2 for high performance enhancement in ultra-low temperature NH3-SCR Enhanced Data Rates for GSM Evolution ; Atom (system on chip) ; Materials science ; Chemistry ; Atomic physics ; Physics ; Engineering ; Telecommunications ; Embedded system Catalytic Processes in Materials Science ; Semiconductor materials and devices ; ZnO doping and properties
Authors: Mrinal K. Hota | Sebastián Pazos | Mario Lanza | Husam N. Alshareef
Source: Materials Science and Engineering R Reports (review, 2025-04-02)
Field: Materials Science — Materials Chemistry

A review of MXene memristors and their applications Memristor ; Computer science ; Materials science ; Nanotechnology ; Engineering ; Electrical engineering MXene and MAX Phase Materials ; Advanced Memory and Neural Computing ; Ferroelectric and Negative Capacitance Devices
Authors: Mohamed El-Sayed M. Essa | Mohammed Ali | E. E. El-Kholy | Mohammed Amer | Mahmoud Elsisi | Uzair Sajjad | Khalid Hamid | Hilmy Awad
Source: Heliyon (review, 2025-01-23)
Field: Materials Science — Electronic, Optical and Magnetic Materials

Improving micro-grid management: A review of integration of supercapacitor across different operating modes The field of electrical energy is moving through many rapid changes and continuous development, especially with the huge boom in the field of artificial intelligence (AI) and the presence of renewable energy systems (RESs). Simultaneously with this development, it was necessary to have energy storage systems such as super capacitors and batteries. This necessity increased with sudden changes in climate or loads that affect the output of generation systems such as solar and wind energy systems. The main goal of this study is to focus on supercapacitors as a future solution with high reliability. It studies all the various factors and operational modes such as the principle of operation, installation, types and modeling of supercapacitors. The study also focused on the employment of supercapacitors in diverse applications, especially in microgrids with their various systems including control and energy management strategies for these systems and investigating the integration between AI, supercapacitors and microgrids and the outcome of this integration. Besides, this research intends to a proposal for a hybrid energy storage systems (HESS) suitable for different loads, including solar cells as main source with supercapacitors and batteries. In addition, it proposes the energy management system (EMS) as well as appropriate control system, to solve the problems of utilities and microgrids and meet the power demand of loads for different operating conditions. Supercapacitor ; Grid ; Nanotechnology ; Engineering ; Computer science ; Systems engineering ; Materials science ; Chemistry ; Capacitance ; Mathematics ; Electrode Supercapacitor Materials and Fabrication ; Microgrid Control and Optimization ; Advanced battery technologies research
Authors: Yun‐Lan Li | Hai‐Ling Wang | Ju‐Fen Ai | Guanghui Zhang | Hua‐Hong Zou | Fu‐Pei Liang | Zhong‐Hong Zhu
Source: Advanced Science (article, 2025-05-20)
Field: Chemistry — Inorganic Chemistry

Respiration Drives Dynamic Metal–Organic Framework for Smart Photoresponse to Volatile Toxic Vapors and Their Photodynamic Sterilization Using aggregation-induced emission luminous (AIEgens) containing dynamic molecular rotor structures as linkers to construct flexible smart luminescent metal-organic frameworks (MOFs) has become a transformative approach to constructing artificial intelligence color-changing materials. Herein, 4',4″,4'″,4″″-(ethene-1,1,2,2-tetrayl)tetrabiphenyl-4-carboxylic acid (H<sub>4</sub>TPPE) is selected as a linker, and octahedral Zr<sub>6</sub>O<sub>4</sub>(OH)<sub>8</sub>(H<sub>2</sub>O)<sub>4</sub> cluster are used as secondary building unit (SBU) to construct the first smart luminescent MOF (Zr-TPE-MOF) that can be driven by CH<sub>2</sub>Cl<sub>2</sub> or CH<sub>3</sub>COOH vapor for respiration. It is worth noting that Zr-TPE-MOF can absorb trace amounts of CH<sub>2</sub>Cl<sub>2</sub> or CH<sub>3</sub>COOH vapor into the pores through respiration and shows a blue shift of the emission wavelength up to 479 nm and an increase of emission intensity by nearly three times. In addition, the thermochromic behavior of Zr-TPE-MOF is not obvious in the temperature range of 80-350 K, but it has obvious thermofluorochromics behavior in the temperature range of 350-470 K. Zr-TPE-MOF showed highly sensitive and visualized smart photoresponse to the highly toxic Cr<sub>2</sub>O<sub>7</sub> <sup>2-</sup>, with a detection limit as low as 7.49 µm. Benefiting from the porous framework structure and organic-inorganic hybrid characteristics of Zr-TPE-MOF, it has excellent ROS generation ability and has excellent application prospects in photodynamic sterilization and rapid degradation of colored dyes. Metal-organic framework ; Luminescence ; Materials science ; Porosity ; Thermochromism ; Chemistry ; Chemical engineering ; Photochemistry ; Optoelectronics ; Organic chemistry ; Composite material Metal-Organic Frameworks: Synthesis and Applications ; Nanoplatforms for cancer theranostics ; Covalent Organic Framework Applications
Authors: Luís Oliveira | Noemi Raquel Checca Huaman | Sérgio Neves Monteiro | Ulisses Oliveira Costa | Letícia Vitorazi
Source: Journal of Materials Research and Technology (article, 2025-01-31)
Field: Materials Science — Biomaterials

Characterization and optimization of cerium oxide nanoparticle-doped cellulose acetate films using the Box-Behnken Design The demand for UV-absorbing materials has increased due to health concerns and the need for improved protective coatings and packaging. This study develops cellulose acetate (CA) films incorporating cerium oxide (CeO₂) nanoparticles (NPs), using acetic acid as a solvent and polyethylene glycol (PEG) as a plasticizer, via the casting method. A comprehensive characterization was conducted using SEM, AFM, EDS, XRD, TEM, SAED, EELS, TGA, DSC, UV–Vis spectroscopy, and tensile testing. The Box-Behnken Design (BBD) was applied to optimize the effects of CeO₂ concentration, PEG content, and drying temperature on mechanical, thermal, and optical properties. The films exhibited enhanced UV absorption, with CeO₂ increasing absorbance at 316 nm, while PEG influenced a nonlinear absorption response at 211 nm. XRD, TEM, and SAED confirmed the high crystallinity of CeO₂, while EELS revealed Ce³⁺/Ce⁴⁺ oxidation states and oxygen vacancies, contributing to UV absorption. Thermal stability improved with CeO₂, with Tg reaching 252.8 °C at 5 wt% CeO₂ (+23.3%), while PEG reduced Tg (213.1 °C) and degradation onset (341.6 °C). Optimized films exhibited superior mechanical properties, achieving 45.39 MPa tensile strength, 2.090 GPa modulus, and 24.38% strain at break, surpassing commercial CA materials. SEM, EDS, and AFM confirmed a well-dispersed CeO₂ phase, reducing surface roughness from 22.3 nm to 8.4 nm. These findings demonstrate that CeO₂-doped CA films offer superior UV protection, mechanical strength, and thermal stability, making them promising for industrial applications. The integration of BBD with advanced nanomaterial characterization provides a data-driven framework for optimizing multifunctional materials. Materials science ; Box–Behnken design ; Cerium oxide ; Nanoparticle ; Doping ; Characterization (materials science) ; Cellulose acetate ; Chemical engineering ; Cerium ; Oxide ; Cellulose ; Nanotechnology ; Nuclear chemistry ; Metallurgy ; Chromatography ; Response surface methodology ; Optoelectronics Advanced Cellulose Research Studies ; Electrospun Nanofibers in Biomedical Applications ; biodegradable polymer synthesis and properties
Authors: Wang Ying-ji | Jin Sun | Liping Zhou | Guangrun Wu | Siqi Gong | Zibo Gao | Jing Wu | Chaochao Ma | Yun Zou | Xiaoyu Liu | Rong Ma | Xin Zhang | Zhaoying Zhang | Yang Li
Source: Analytical Chemistry (article, 2025-02-04)
Field: Materials Science — Electronic, Optical and Magnetic Materials

Highly Sensitive and Interference-Free Detection of Multiple Drug Molecules in Serum Using Dual-Modified SERS Substrates Combined with AI Algorithm Analysis Surface-enhanced Raman spectroscopy (SERS) technology has shown broad potential in drug concentration detection, but its application in blood drug monitoring faces significant challenges. The primary difficulty lies in overcoming the interference caused by various biomolecules present in serum, which can severely obscure the SERS signals of target drug molecules. Traditional enhancement substrates are often limited to detecting single drugs and are prone to interference, making the label-free detection of multiple drugs particularly challenging. To address these issues, we developed a novel SERS substrate based on Au@AgNRs, which undergoes a two-step modification to produce Au@AgDBCNRs. This innovative substrate provides exceptional signal amplification, simultaneously allowing the sensitive detection of multiple drug molecules. Moreover, our method eliminates the need for serum deproteinization, enabling the direct detection of drugs in serum while effectively mitigating interference from blood components. The cetyltrimethylammonium bromide coating on Au@AgDBCNRs is an internal standard for drug quantification without additional standards. The platform significantly improves detection accuracy and efficiency by automatically integrating artificial intelligence to recognize and analyze Raman spectral features. This novel SERS platform provides a new idea for therapeutic drug monitoring and is expected to provide rapid, accurate, and cost-effective drug detection in the clinical environment, which has great potential in improving patient care and optimizing drug dosage strategies. Biomolecule ; Drug detection ; Chemistry ; Drug ; Interference (communication) ; Therapeutic drug monitoring ; Surface-enhanced Raman spectroscopy ; Substrate (aquarium) ; Nanotechnology ; Coating ; Drug discovery ; Raman spectroscopy ; Drug target ; Computer science ; Chromatography ; Raman scattering ; Materials science ; Pharmacology Gold and Silver Nanoparticles Synthesis and Applications ; Spectroscopy Techniques in Biomedical and Chemical Research ; Biosensors and Analytical Detection
Authors: Liying Li | Gui‐Yu Jin | Jian Shen | Mengyan Guo | Jiacheng Song | Yiming Li | Jian Xiong
Source: Gels (review, 2025-07-15)
Field: Chemistry — Spectroscopy

Carbon Aerogels: Synthesis, Modification, and Multifunctional Applications Amidst global imperatives for sustainable energy and environmental remediation, carbon aerogels (CAs) present a transformative alternative to conventional carbon materials (e.g., activated carbon, carbon fibers), overcoming limitations of disordered pore structures, unmodifiable surface chemistry, and functional inflexibility. This review systematically examines CA-based electrochemical systems as its primary focus, analyzing fundamental charge-storage mechanisms and establishing structure-property-application relationships critical to energy storage performance. We critically assess synthesis methodologies, emphasizing how stage-specific parameters govern structural/functional traits, and detail multifunctional modification strategies (e.g., heteroatom doping, composite engineering) that enhance electrochemical behavior through pore architecture optimization, surface chemistry tuning, and charge-transfer kinetics acceleration. Electrochemical applications are extensively explored, including the following: 1. Energy storage: supercapacitors (dual EDLC/pseudocapacitive mechanisms) and battery hybrids. 2. Electrocatalysis: HER, OER, ORR, and CO<sub>2</sub> reduction reaction (CO<sub>2</sub>RR). 3. Electrochemical processing: capacitive deionization (CDI) and electrosorption. Beyond this core scope, we briefly acknowledge CA versatility in ancillary domains: environmental remediation (heavy metal removal, oil/water separation), flame retardancy, microwave absorption, and CO<sub>2</sub> capture. Carbon fibers ; Materials science ; Nanotechnology ; Chemical engineering ; Composite material ; Engineering Aerogels and thermal insulation ; Supercapacitor Materials and Fabrication ; Advanced Sensor and Energy Harvesting Materials
Authors: Mohammed Faraj Saeid | Bashir Abubakar Abdulkadir | M. Ismail | Herma Dina Setiabudi
Source: Environmental Quality Management (article, 2025-01-27)
Field: Materials Science — Materials Chemistry

A Bibliometric Analysis of Metal‐Based Catalysts for Efficient Hydrogen Production ABSTRACT This study investigates global research trends on the catalytic performance of metal‐based catalysts for enhanced hydrogen production over the past 89 years (1935–2024) through a comprehensive bibliometric analysis. The research addresses the evolution of metal‐based catalysts in hydrogen production and highlights the most prominent contributors and driving trends. The study analyzed 32,987 peer‐reviewed studies identified through Scopus database. The search was conducted from September 1, 1935, to July 20, 2024, utilizing keywords such as “(TITLE‐ABS‐KEY ((“Ru” OR “Ni” OR “Fe” OR “Co” OR “Mo” OR “Pt” OR “Pd” OR “Cr” OR “metal catalysts*”) AND (“hydrogen production*” OR “H 2 production*” OR “hydrogen generation*” OR “H 2 generation*”))).” The analysis covered various aspects, such as countries, authors’ affiliations, prominent journals, research areas, and key terms driving discussions in the field. It also noted that researchers with fewer publications may have been overlooked. Bibliometric parameters, including publication counts, citations, total link strength (TLS), and collaboration networks, were examined. Results indicate a steady rise in publications, with significant growth observed from 2000 onwards. The most recent period (2019–2024) alone accounted for 55.6% of the total publications, with a notable 26.5% growth from 2021 to 2022. China leads in both publication volume and TLS, followed by the United States and the United Kingdom. The International Journal of Hydrogen Energy ( IJHE ) emerged as the top journal with 4653 relevant articles. The analysis reveals a shift in focus from early studies on iron and platinum to a more recent emphasis on nickel‐based catalysts and hydrogen evolution reactions (HER). These findings highlight several challenges, including the need to improve catalyst efficiency, address scalability issues, and develop more sustainable catalytic materials. Future research should focus on advancing catalyst design, optimizing reaction conditions, and enhancing catalytic stability for large‐scale hydrogen production. Catalysis ; Production (economics) ; Hydrogen production ; Hydrogen ; Environmental science ; Metal ; Business ; Chemistry ; Materials science ; Economics ; Metallurgy ; Organic chemistry Machine Learning in Materials Science ; Catalytic Processes in Materials Science ; Catalysts for Methane Reforming
Authors: Neetu Bansal | Nitish Kumar | Prakash Kumar Pathak | Heejoon Ahn | Jing Tang | Yusuke Yamauchi | Rahul R. Salunkhe
Source: Advanced Materials (review, 2025-06-12)
Field: Materials Science — Materials Chemistry

The Versatility of Layered Two‐Dimensional Heterostructures for Energy Storage: Bridging Scientific Insights and Practical Applications Nanoscale manipulation of electronic and ionic charge interactions within electrode materials is the cornerstone for advancing electrochemical energy storage. Compared to bulk materials, 2D confined anodes provide lamellar channels to mobile ions for electrochemical interactions. However, individual 2D layers are often inefficient in delivering desired properties for stable and rapid kinetics in battery operations. To address this, 2D-2D heterostructures (2D HRs) that integrate the properties of two or more layers via van der Waals or covalent bonds can give optimized interfacial features. These structures modulate electronic properties, such as band positions, activation energies, diffusion barriers, and binding energies for intercalating ions, thereby regulating the electrochemical characteristics of batteries to meet practical challenges. In this context, this review includes the latest experimental and theoretical investigations to explore the multifunctional roles of 2D HRs in monovalent ion (Li<sup>+</sup>, Na<sup>+</sup>, and K<sup>+</sup>) batteries (MIBs). First, it elucidates the fundamentals concerning the impacts of HRs in charge storage mechanisms and outlines pathways for synthesizing their novel designs. Then, it summarizes the different configurations of 2D HRs utilized in designing MIBs. Finally, it underscores the current challenges and future perspectives for implementing 2D HRs as advanced anode materials in batteries. Bridging (networking) ; Materials science ; Nanotechnology ; Energy storage ; Heterojunction ; Engineering physics ; Optoelectronics ; Computer science ; Engineering 2D Materials and Applications ; MXene and MAX Phase Materials ; Graphene research and applications
Authors: Xudong Tao | Qianfang Zheng | Chongyang Zeng | Harry Potter | Zheng Zhang | Joshua Ellingford | Ruy S. Bonilla | Emiliano Bilotti | Patrick S. Grant | Hazel E. Assender
Source: Nature Communications (article, 2025-01-03)
Field: Materials Science — Materials Chemistry

Cu- or Ag-containing Bi-Sb-Te for in-line roll-to-roll patterned thin-film thermoelectrics The Selective Metallization Technique shows promise for roll-to-roll in-line patterning of flexible electronics using evaporated metals, but challenges arise when applied to sputtering functional materials. This study overcomes these challenges with simultaneous sputtering of Bi-Sb-Te and evaporation of metal (Ag or Cu) for thermoelectric layers when using Selective Metallization Technique. Large-scale manufacturing is demonstrated through roll-to-roll processing of a 0.8 m wide polymer web at 25 m/min, achieving high-throughput production of functional thin-film patterns with nanometer thickness. The room-temperature-deposited material system exhibits significantly enhanced thermoelectric performance and facilitates an n-type-to-p-type transition in the Cu- or Ag-containing Bi-Sb-Te-based composite film. Here, we show that while applying Selective Metallization Technique, the evaporation of metal modifies the impact of residual oil on Bi-Sb-Te, which can be effectively removed with a few seconds of plasma exposure, and the fabricated thermoelectric devices are validated in wearable applications utilizing a coiled-up wristband design. Materials science ; Roll-to-roll processing ; Sputtering ; Thermoelectric effect ; Optoelectronics ; Thin film ; Evaporation ; Thermoelectric materials ; Nanotechnology ; Electronics ; Composite material ; Electrical engineering ; Thermal conductivity Advanced Thermoelectric Materials and Devices ; Advanced Sensor and Energy Harvesting Materials ; Thermal Radiation and Cooling Technologies