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adsorption

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• Trace Li Pre-Doping of Activated Carbon Cathode Enabling Accelerated Li-Ion Transport for High-Power Lithium-Ion Capacitors.
  2026 · AI 驱动科学发现 · Rapid expansion of AI-driven data centers demands energy storage systems that simultaneously deliver high power, safety, and practical scalability. Lithium-ion capacitors (LICs) are attractive candidates; however, their …
• Investigation of cyanometallate coordination polymers with tetraamines for carbon capture.
  2026 · 碳中和与 CCUS · Abstract Research into carbon capture, utilization, and storage (CCUS) from point sources and the atmosphere is essential for reducing greenhouse gas emissions and limiting the increase in global average temperature to w…
• Machine-learning interatomic potential for barium sulfide: From thermodynamic properties to crystal growth kinetics.
  2025 · AI 驱动科学发现 · We developed a neural network-based interatomic potential (DeePMD) for the semiconductor barium sulfide (BaS), trained on first-principles simulations of both the solid and liquid phases. Using molecular dynamics, we eva…
• Machine-learning interatomic potential for BaTiO<sub>3</sub>: phase transitions, domain walls, and grain boundaries.
  2025 · AI 驱动科学发现 · Abstract A machine learning interatomic potential for BaTiO 3 is presented based on the atomic cluster expansion formalism, enabling atomistic simulations of phase transitions, defect structures, and domain walls. Traine…
• Black-Tipped Wing Alignment in V-Formation: Aerodynamic Implications for Avian Flight Efficiency
  2026 · AI 安全与对齐 · Birds frequently fly in a V-shape because this formation helps them use less energy by taking advantage of the airflow created by the birds in front. In many species, particularly seabirds such as gulls, the distal wing …
• Development of a machine-learning interatomic potential for molecular dynamics simulations of titanium-based MXenes under aqueous lubrication
  2026 · AI 驱动科学发现 · Lubricants form protective films that separate sliding surfaces, but under boundary lubrication conditions these films can be displaced, making surface-active additives critical to prevent direct solid–solid contact. Two…
• Estimating Potential-Dependent Physicochemical Properties at Metal–Electrolyte Interfaces Using Machine Learning Interatomic Potentials
  2026 · AI 驱动科学发现 · Metal–electrolyte interfaces play a central role in electrocatalysis, energy storage, and environmental remediation. Understanding the structure and properties of these interfaces is therefore essential to designing effi…
• Phosphorus-based lubricant additives on iron with Machine Learning Interatomic Potentials
  2026 · AI 驱动科学发现 · Phosphorus-based lubricant additives protect metallic contacts under boundary lubrication by forming surface films that reduce wear and friction. However, the molecular mechanisms driving their friction-reducing effects …
• Multiscale insights into the diffusion of SF6/N2 mixtures via machine-learning interatomic potentials
  2026 · AI 驱动科学发现 · Sulfur hexafluoride (SF 6 ) is widely used as an insulating and arc-extinguishing medium in high-voltage electrical equipment due to its excellent dielectric properties and insulation performance. However, SF 6 is also a…
• Flotation of rare earth minerals from Italian granite waste: mineralogy, reagent evaluation and process optimization
  2026 · 地外矿物 · The recovery of rare earth elements (REEs) from secondary sources is increasingly important for strengthening the European supply chain and reducing the environmental impact of primary mining. This study evaluates the po…
• Flash calcination of fine spodumene concentrate in the Calix reactor
  2026 · 地外矿物 · A spodumene concentrate containing 6.0% Li2O with a size range of 90% passing 200 μm was calcined in a Calix reactor, a new type of flash calcination reactor, between 1050°C and 1120°C converting up to 88% of the α-spodu…
• Molecular Modeling of Arsenic Species Adsorption on Clay Minerals and in the Presence of Organic Matter
  2026 · 地外矿物 · Arsenic (As) contamination of soils is a critical environmental and geochemical concern, with its mobility and bioavailability largely controlled by molecular-scale interactions with soil minerals. This study investigate…
• Filtration mechanism of copper tailings: Influence of initial solids content and flocculation
  2026 · 地外矿物 · Cake filtration is increasingly applied in tailings management to achieve high solids contents for backfill preparation, dry stacking, and co-disposal with waste rock; however, the combined effects of initial solids cont…
• Microscopy dataset and image analysis code from timelapse imaging of individual steps in the lytic bacteriophage life cycle in single bacterial cells
  2026 · 生物计算 · IntroductionThis dataset is a companion to the work presented in the preprint “Single-cell imaging of the lytic phage life cycle in bacteria” [1]. If you use this dataset in your work, please cite our preprint. A full de…
• Performance Optimization of Al-Zn-In-Sn-Mg Al-Based Sacrificial Anodes in Oilfield Produced Water Environments with Carbon Capture, Utilization, and Storage Technologies
  2026 · 碳中和与 CCUS · To address activation and durability of Al-based sacrificial anodes in carbon capture, utilization, and storage (CCUS) weakly acidic chloride-rich environments, this study investigated electrochemical performance and cor…
• Environmental performance of olive stone–plastic waste activated carbon composites
  2026 · 碳中和与 CCUS · , thereby reducing the amount of adsorbent required for effective pollutant removal. To capture both production efficiency and application relevance, LCA was conducted using two functional units: per kg of AC composite p…
• Porous Carbon-Based Adsorbents for CO2 Sequestration from Flue Gases: Tuning Porosity, Surface Chemistry, and Metal Impregnation for Sustainable Capture
  2026 · 碳中和与 CCUS · Escalating atmospheric CO2 levels and the consequent climate crisis have become urgent imperatives for advancing efficient carbon capture technologies. Porous carbon adsorbents stand out as a leading candidate in this fi…
• DFT-Based Study of CO2 Adsorption Mechanism on Carbon Materials
  2026 · 碳中和与 CCUS · Carbon-based material adsorption is one of the research hotspots in the Carbon Capture, Utilization, and Storage (CCUS) field, and its surface functional groups have a significant impact on CO2 adsorption performance. Th…
• Nanobiosensors for Precision Farming and Sustainable Agriculture
  2025 · 智慧农业 · An overview of nanobiosensors for sustainable agriculture and precision farming is given in this chapter. Throughout every single phase of the agricultural product processing, biosensors are introduced during the pregrow…
• EFFICIENCY OF LABOR OPERATIONS WHEN FEEDING MIXTURE ON FEEDING TABLES
  2025 · 智慧农业 · The article presents the results of the analysis of labor operations carried out in the process of mechanized distribution and feeding of feed mixtures in free housing of animals The article presents the results of the a…
• Pengaruh Gaya Kepemimpinan Kepala Sekolah dan Motivasi Kerja Terhadap Kinerja Guru SMA Negeri di Kecamatan Baturaja Timur
  2025 · AI 安全与对齐 · This research aims to analyze the influence of the principal's leadership style on the performance of State High School teachers in East Baturaja District; and explore the influence of work motivation on the performance …
• Unraveling the Effects of Pore Size and Diamine Functionalization on CO2 Diffusion in Metal-Organic Frameworks using Machine-Learning Interatomic Potentials
  2025 · AI 驱动科学发现 · M2(dobdc) (dobdc4- = 2,5-dioxido-1,4-benzenedicarboxylate; M = Mg, Mn, Fe, Co, Ni, Cu, Zn), commonly referred to as M-MOF-74, and its variants have been extensively studied for their outstanding CO2 capture performance. …
• Exploring the energy landscape of aluminas through machine learning interatomic potential
  2025 · AI 驱动科学发现 · Despite the widespread applications of alumina due to its rich polymorphism, the structures of many transitional aluminas remain unresolved. This work employs the neuroevolution potential (NEP) approach to accurately des…
• Understanding Dynamics of Nanocluster-Organic Frameworks and Gas Diffusion from Machine Learning Potential-based Simulations
  2025 · AI 驱动科学发现 · Nanocluster-organic frameworks (NOFs) have emerged as unique materials with broad applications in sensing, photocatalysis, and optoelectronics. These photofunctional materials have an excellent luminescence switching res…
• Characteristic changes of calcined clay minerals as heavy metal adsorbents
  2025 · 地外矿物 · Abstract Calcined clay minerals were examined as adsorbents for the removal of heavy metals from aqueous solutions. Five clay minerals (kaolinite, dickite, pyrophyllite, hydrobiotite and montmorillonite) were thermally t…
• Surface chemistry modifications in grinding and flotation of spodumene
  2025 · 地外矿物 · This study investigated the effects of different grinding environments on the flotation behaviour of spodumene from lithium pegmatite ore through bench-scale froth flotation tests using sodium oleate (NaOL) collector. Th…
• Optimizing water purification with Shungite: a metric approach for characterizing its efficiency in removing contaminants
  2025 · 地外矿物 · Abstract Shungite is a Precambrian carbon-rich metamorphic rock from the Lake Onega region (Karelia, Russia), consisting of fullerene-like polyhedral carbon within a silicate matrix. Its high carbon content and extended …
• From Waste to Worth: Innovative Pyrolysis of Textile Waste into Microporous Carbons for Enhanced Environmental Sustainability
  2025 · 碳中和与 CCUS · The generation of synthetic textile waste is a growing global concern, with an unsustainable rate of expansion. This study addresses the growing issue of synthetic textile waste by converting polyester–polyurethane (PET-…
• Recent Developments in Polymeric Adsorbents for CO 2 Capture
  2025 · 碳中和与 CCUS · Abstract The increasing reliance on fossil fuels and anthropogenic activities has led to rising CO 2 emissions, contributing significantly to global warming. Carbon capture technologies are essential in mitigating these …
• Efficient CO2 Capture Using Nitrogen-Enriched Microporous Carbon Derived from Polybenzoxazine in a Single-Step Process for Environmental Sustainability
  2025 · 碳中和与 CCUS · In this research, we successfully synthesized nitrogen-enriched microporous carbon through a meticulous process involving two different activation procedures. Initially, polybenzoxazine was carbonized at 800 °C to create…
• Enhanced phenol removal from wastewater via sulfuric acid activated eggshell derived carbon
  2025 · 碳中和与 CCUS · This research explores the development of an innovative activated carbon adsorbent (ACES) derived from waste eggshells through sulfuric acid activation to effectively remove phenol from simulated wastewater. Optimization…
• Role of Water Content in CO ₂ –Anorthite Mineralization: Reactive Molecular Dynamics Simulations
  2025 · 碳中和与 CCUS · Mineralization is a key mechanism for geological CO 2 storage, with feldspar emerging as a promising candidate due to its high carbon sequestration potential and long-term storage stability. In this study, anorthite is e…
• Mechanistic Study on CO2-N2 Chromatographic Partitioning in Saline Aquifers
  2025 · 碳中和与 CCUS · Summary Underground sequestration of carbon dioxide is an effective way to deal with climate change. CO2-N2 chromatographic partitioning in saline aquifers can help separate CO2 and N2, leaving CO2 storage and N2 enrichm…
• Hydroxyl-Incorporated Microporous Polymer Comprising 3D Triptycene for Selective Capture of CO 2 over N 2 and CH 4
  2025 · 碳中和与 CCUS · High Resolution Image Download MS PowerPoint Slide The rising CO 2 concentration in the atmosphere contributes significantly to global warming, necessitating effective carbon capture techniques. Amine-based solvents are …
• Effect of Metal Modification of Activated Carbon on the Hydrogen Adsorption Capacity
  2025 · 碳中和与 CCUS · This study investigates the hydrogen adsorption performance of activated carbon (AC) derived from rice husks and modified with magnesium and nickel salts. Adsorption isotherms were recorded at 25 °C and 50 °C up to 80 ba…
• Tailored Metal-Doped Activated Carbon Adsorbents Exhibiting High-Capacity, Selective, and Reversible Hydrogen Storage at Room Temperature
  2025 · 碳中和与 CCUS · High Resolution Image Download MS PowerPoint Slide Storage is one of the main challenges that hinders the wide implementation of hydrogen as a fuel. Focusing on storage at room temperature conditions, metal-decorated act…
• Green synthesis of ZnS/MoS2-decorated porous carbon for photocatalytic degradation of tetracycline under visible light
  2025 · 碳中和与 CCUS · Abstract This study investigated a one-step green pyrolysis method inspired by chemical vapor deposition, utilizing melamine and zinc nitrate precursors with varying sulfur content for degradation and adsorption of tetra…
• Storage of supercritical carbon dioxide in nanoporous media
  2025 · 碳中和与 CCUS · This study investigates the adsorption behavior of supercritical carbon dioxide (scCO 2 ) in nanoporous materials , with a particular focus on the effects of temperature and pore size. Using a novel gravimetric method , …
• Insights into the Adsorption of Carbon Dioxide in Zeolites ITQ-29 and 5A Based on Kinetic Measurements and Molecular Simulations
  2025 · 碳中和与 CCUS · Understanding the adsorption mechanism is essential for developing efficient technologies to capture carbon dioxide from industrial flue gases. In this work, laboratory measurements, density functional theory calculation…
• Mesh-like structure integrated core-shell-shell nanocomposites for enhanced stability and performance in carbon capture
  2025 · 碳中和与 CCUS · Carbon capture is essential for mitigating climate change, yet most sorbents struggle to combine high capacity with chemical stability. Here we report core-shell-shell (CSS) nanocomposites that integrate adsorption effic…
• Effect of Microfractures on the Seepage Characteristics of Hydrate Bearing Rocks under Confining Pressure
  2025 · 碳中和与 CCUS · Summary The technology of methane production through the replacement of carbon dioxide in gas hydrates without their decomposition involves the cyclic injection and extraction of gas. Under cyclic pore pressure, predicti…
• Preparation of Mesoporous Boron-Doped Porous Carbon Derived from Coffee Grounds via Hybrid Activation for Carbon Capture and Storage
  2025 · 碳中和与 CCUS · The increasing concentration of carbon dioxide (CO2) in the atmosphere necessitates the development of efficient carbon capture and storage (CCS) technologies. Among these, adsorption-based methods using porous carbon (P…
• Prediction of CO2 capture performance of a direct air capture unit under representative atmospheric flow conditions using large eddy simulation
  2025 · 碳中和与 CCUS · The removal of carbon dioxide (CO 2 ) from the atmosphere using direct air capture (DAC) is crucial in achieving the net-zero emissions target and combating global warming. We develop a new numerical model that predicts …
• Adsorption Application of Choline Chloride Modified MIL-101 (Cr) in Carbon Capture and Storage
  2025 · 碳中和与 CCUS · This study developed a new way of designing choline chloride-modified MOF-based materials with advanced gas adsorption properties. To design better carbon capture materials, MIL-101 (Cr) was prepared using the hydrotherm…
• Adsorption-Induced Deformation in Microporous Kerogen by Hydrogen and Methane: Implications for Underground Hydrogen Storage
  2025 · 碳中和与 CCUS · High Resolution Image Download MS PowerPoint Slide Accurately assessing the adsorption and diffusion behaviors of H 2, CH 4, and their mixtures are essential for estimating underground hydrogen storage (UHS). This unders…
• Dynamic Temperature–Vacuum Swing Adsorption for Sustainable Direct Air Capture: Parametric Optimisation for High-Purity CO2 Removal
  2025 · 碳中和与 CCUS · Direct air capture (DAC), as a complementary strategy to carbon capture and storage (CCS), offers a scalable and sustainable pathway to remove CO2 directly from the ambient air. This study presents a detailed evaluation …
• Functionalized Carbon-Based Materials for Uranium Extraction: A Review
  2025 · 碳中和与 CCUS · The development of effective materials for uranium extraction from seawater is vital for advancing sustainable energy solutions. However, the efficient recovery of uranium from seawater presents significant challenges du…
• Coal matrix response to CO2 adsorption and emission: implications for sustainable mining and carbon sequestration
  2025 · 碳中和与 CCUS · This study investigates the coal matrix response to CO₂ adsorption and emission, exploring its potential for sustainable carbon sequestration in abandoned coal mines, mineable and un-nimeable coal layers. Unlike previous…
• Carbon Aerogel for Aqueous Phase Adsorption/Absorption: Application Performances, Intrinsic Characteristics, and Regulatory Constructions
  2025 · 碳中和与 CCUS · Carbon aerogels (CAs), owing to their low density, rich pore structure, high specific surface area, and excellent physicochemical stability, possess broad application prospects in the field of pollutant adsorption/absorp…
• Rapid synthesis of phosphomolybdic acid encapsulated ZIF-8 for efficient uranium( vi ) capture from alkaline solution
  2025 · 碳中和与 CCUS · Phosphomolybdic acid hydrate (PMA) encapsulated within a ZIF-8 framework (PMA@ZIF-8) was synthesized and utilized for U(vi) adsorption from the alkaline leach liquor of dolostone material collected from SW Sinai. The pre…
• Plasma-Assisted Regeneration of Activated Carbon: Current Status and Prospects
  2025 · 碳中和与 CCUS · Activated carbon (AC) is widely used in pollution control, but it faces significant challenges in regeneration due to secondary pollution and structural degradation. Traditional methods, such as thermal and chemical rege…
• Phase behavior and atomic dynamics in Rb_<i>x</i>Na_1-<i>x</i>: insights from machine learning interatomic potentials based on<i>ab initio</i>molecular dynamics.
  2024 · AI 驱动科学发现 · Liquid alkali metal alloys have garnered significant attention because of their potential applications in coolant systems and batteries, driven by the need for environmental conservation and technological development. Ho…
• Machine-Learning-Driven High-Throughput Screening for High-Energy Density and Stable NASICON Cathodes.
  2024 · AI 驱动科学发现 · The Na super ionic conductor (NASICON), which has outstanding structural stability and a high operating voltage, is an appealing material for overcoming the limits of low specific energy and larger volume distortion of s…
• Design of a Smart Farming Monitoring System Leveraging Internet of Things Technology: Application of the NPKTHCPH -S Sensor
  2024 · 智慧农业 · Shallot plants are currently widely cultivated, but cultivation is still done manually to control soil conditions. For this reason, with a monitoring system using the NPKTHCPH-S sensor, which can show seven parameters of…
• Diffusion coefficients calculations of 110mAg in ZrC at very high temperature using machine-learning interatomic potential
  2024 · AI 驱动科学发现 · • Machine-learning potential for the Zr-C-Ag ternary system was developed. • Ag diffusion in ZrC 0.94 and ZrC 0.97 was computed using molecular dynamics simulations. • Ag diffusion accelerates with higher temperature and…
• A Genetic Algorithm Trained Machine-Learned Interatomic Potential for the Silicon–Carbon System
  2024 · AI 驱动科学发现 · A linear regression-based machine learned interatomic potential (MLIP) was developed for the silicon–carbon system. The MLIP was predominantly trained on structures discovered through a genetic algorithm, encompassing th…
• Lithium sorption by ion exchange
  2024 · 地外矿物 · The high demand for lithium is increasing drastically due to its applications in electronic devices, electric vehicles, and other components. The present case study focuses on studying the sorption capacity of two resins…
• Rising dynamics of particle-laden bubbles in presence of surfactant and turbulence
  2024 · 地外矿物 · • Rising dynamics of particle-laden bubbles in presence of surfactant and turbulence. • At high bubble surface loadings, the bubble rise velocity increases in turbulence. • At low surface loadings however, the rise veloc…
• Granular Soils and Contaminant Modeling in Tailing Dams
  2024 · 地外矿物 · The granular soils of tailings, encompassing clay, gravel, sand, and silt, play a pivotal role in the behavior and stability of tailings dams. Different types of granular soils significantly influence the tailings materi…
• Computer Simulation Insights into the Chemical Origins of Life: Can HCN Enrichment on Interstellar Amorphous Ice Be a Starting Point?
  2024 · 地外矿物 · The adsorption of HCN at the surface of low-density amorphous (LDA) ice and its dissolution in the bulk LDA phase is studied by grand canonical Monte Carlo (GCMC) simulations at the temperatures of 50, 100, and 200 K, ch…

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