- Intramolecular Design of Poly(ethylene oxide) for Solid-State Electrolytes and Next-Generation High-Energy Batteries
2026/05/18 by Shijun Zhang, Ruiliu Jia, Xiaoyu Ji +9 · 1 voice
Engineering · Materials Science · #Advanced Battery Materials and Technologies #Advancements in Battery Materials #Cationic polymerization #Ceramic #Electrochemistry #Intermolecular force #Intramolecular force #Ionic bonding #Ionic conductivity #Limiting #Rational design #Thermal Expansion and Ionic Conductivity
- Organic ionic plastic crystals having colossal barocaloric effects for sustainable refrigeration
2025/01/02 by Samantha L. Piper, Leena Melag, Mega Kar +7 · 44 citations
Chemistry · Engineering · Materials Science · #Air conditioning #Chemistry #Dielectric materials and actuators #Engineering physics #Ferroelectric and Piezoelectric Materials #Ion #Ionic bonding #Materials science #Organic chemistry #Phase transition #Physics #Plastic crystal #Refrigeration #Shape Memory Alloy Transformations #Thermodynamics
- CHGNet: Pretrained universal neural network potential for charge-informed atomistic modeling
2023/02/28 by Bowen Deng, Deng, Bowen, Peichen Zhong +10 · 17 citations
Computer Science · Engineering · Materials Science · Mathematics · #Ab initio #Artificial intelligence #Artificial neural network #Atomic units #Computer science #Condensed matter physics #Degrees of freedom (physics and chemistry) #Electron #Electronic structure #FOS: Computer and information sciences #FOS: Physical sciences #Fuel Cells and Related Materials #Hamiltonian (control theory) #Ion #Ionic bonding #Machine Learning (cs.LG) #Machine Learning in Materials Science #Materials Science (cond-mat.mtrl-sci) #Mathematics #Molecular dynamics #Phase (matter) #Phase diagram #Physics #Quantum mechanics #Statistical physics #Topic Modeling
- Anion-Exchange Membrane Water Electrolyzers
2022/04/20 by Naiying Du, Claudie Roy, Retha Peach +4 · 993 citations
Chemistry · Energy · Engineering · #Advanced battery technologies research #Catalysis #Cationic polymerization #Chemical engineering #Chemistry #Conductivity #Electrocatalysts for Energy Conversion #Electrochemistry #Electrode #Fuel Cells and Related Materials #Inorganic chemistry #Ion #Ion exchange #Ionic bonding #Ionic conductivity #Ionic liquid #Limiting current #Materials science #Membrane #Nanotechnology #Organic chemistry #Oxygen evolution #Physical chemistry #Polymer chemistry #Water splitting
- Quantum capacitance of supercapacitor electrodes based on the F-functionalized M2C MXenes: A first-principles study
2022/04/09 by Hai‐Tao Yan, Hai-Tao Yan, Xiao-Hong Li +9 · 29 citations
Chemistry · Materials Science · #Anode #Aqueous solution #Capacitance #Cathode #Chemical engineering #Chemistry #Electrode #Graphene research and applications #Ion #Ionic bonding #Ionic liquid #MXene and MAX Phase Materials #MXenes #Materials science #Nanotechnology #Organic chemistry #Physical chemistry #Supercapacitor #Supercapacitor Materials and Fabrication
- Molecular Mean-Field Theory of Ionic Solutions: A Poisson-Nernst-Planck-Bikerman Model
2020/04/20 by Jinn‐Liang Liu, Jinn-Liang Liu, Bob Eisenberg · 69 citations
Chemistry · Engineering · Mathematics · Physics and Astronomy · #Electrostatics and Colloid Interactions #Field (mathematics) #Ion #Ionic bonding #Mathematical physics #Mathematics #Mean field theory #Molecular Junctions and Nanostructures #Nernst equation #Physics #Planck #Poisson distribution #Pure mathematics #Quantum mechanics #Spectroscopy and Quantum Chemical Studies #Statistical physics #Statistics #cond-mat.soft
- Research Development on K-Ion Batteries
2020/01/15 by Tomooki Hosaka, Kei Kubota, A. Shahul Hameed +1 · 1 voice · 1,336 citations
Chemistry · Engineering · #Advanced Battery Materials and Technologies #Advanced battery technologies research #Advancements in Battery Materials #Battery (electricity) #Chemistry #Electrochemistry #Electrode #Electrolyte #Energy density #Energy storage #Engineering #Engineering physics #Ion #Ionic bonding #Materials science #Nanotechnology #Physical chemistry #Physics #Power (physics)
- Constructive molecular configurations for surface-defect passivation of perovskite photovoltaics
2019/12/20 by Rui Wang, Jingjing Xue, Kai-Li Wang +19 · 1,316 citations
Chemistry · Engineering · Materials Science · #Chalcogenide Semiconductor Thin Films #Chemical physics #Chemistry #Crystallography #Halide #Inorganic chemistry #Ion #Ionic bonding #Materials science #Molecule #Nanotechnology #Organic chemistry #Passivation #Perovskite (structure) #Perovskite Materials and Applications #Photovoltaic system #Photovoltaics #Quantum Dots Synthesis And Properties
- Gate-tunable room-temperature ferromagnetism in two-dimensional Fe3GeTe2
2018/03/06 by Yujun Deng, Yijun Yu, Yichen Song +12 · 2,617 citations
Chemistry · Materials Science · Physics and Astronomy · #2D Materials and Applications #Chemistry #Condensed matter physics #Curie temperature #Ferromagnetism #Graphene research and applications #Ion #Ionic bonding #Magnetic anisotropy #Magnetic field #Magnetization #Magnetocrystalline anisotropy #Materials science #Monolayer #Nanotechnology #Physics #Spintronics #Thin film #Topological Materials and Phenomena #cond-mat.mtrl-sci #van der Waals force
- Charge neutrality breakdown in confined aqueous electrolytes: Theory and simulation
2016/09/02 by Thiago Colla, Matheus Girotto, Alexandre P. dos Santos +1 · 52 citations
Chemical Engineering · Chemistry · Mathematics · Physics and Astronomy · #Aqueous solution #Charge (physics) #Charge density #Chemical and Physical Properties in Aqueous Solutions #Chemical physics #Chemistry #Computational chemistry #Computer science #Counterion #Density functional theory #Electrode #Electrolyte #Electrostatics #Electrostatics and Colloid Interactions #Ion #Ionic bonding #Materials science #Mathematics #Monte Carlo method #Organic chemistry #Physical chemistry #Physics #Planar #Quantum mechanics #Spectroscopy and Quantum Chemical Studies #cond-mat.soft
- Dense ionic fluids confined in planar capacitors: in- and out-of-plane structure from classical density functional theory
2016/04/26 by Andreas Härtel, Sela Samin, Rene van Roij +1 · 20 citations
Chemical Engineering · Chemistry · Engineering · Physics and Astronomy · #Capacitance #Charge (physics) #Density functional theory #Dielectric #Dielectric materials and actuators #Electrostatics and Colloid Interactions #Ionic bonding #Ionic liquids properties and applications #Molecular dynamics #Perpendicular #Planar #cond-mat.soft
- Surface properties of atomically flat poly-crystalline SrTiO3
2015/03/06 by Sungmin Woo, Hoidong Jeong, Sang A Lee +8 · 75 citations
Materials Science · Physics and Astronomy · #Annealing (glass) #Electronic and Structural Properties of Oxides #Epitaxy #Ferroelectric and Piezoelectric Materials #Ionic bonding #Machine Learning in Materials Science #Metal #Substrate (aquarium) #Surface (topology) #Thermal conduction #Translational symmetry #cond-mat.mtrl-sci
- Multiferroicity in TTF-CA Organic Molecular Crystals Predicted throughAb InitioCalculations
2009/08/22 by Gianluca Giovannetti, Sanjeev Kumar, Alessandro Stroppa +2 · 104 citations
Chemistry · Engineering · Materials Science · Physics and Astronomy · #Ab initio #Ab initio quantum chemistry methods #Antiferromagnetism #Chemistry #Condensed matter physics #Dielectric #Electronic structure #Ferroelectricity #Ion #Ionic bonding #Materials science #Molecule #Multiferroics #Organic and Molecular Conductors Research #Perovskite Materials and Applications #Physical chemistry #Physics #Polarization (electrochemistry) #Quantum mechanics #Solid-state spectroscopy and crystallography #cond-mat.mtrl-sci
- Experimental viscosity B-coefficients of aqueous LiCl solutions
2006/02/08 by Ilmutdin M. Abdulagatov, Adelya B. Zeinalova, Nazim D. Azizov · 39 citations
Chemical Engineering · Chemistry · Engineering · #Analytical Chemistry (journal) #Aqueous solution #Atmospheric temperature range #Chemical and Physical Properties in Aqueous Solutions #Chemistry #Chromatography #Electrolyte #Inherent viscosity #Intrinsic viscosity #Ion #Ionic bonding #Materials science #Organic chemistry #Phase Equilibria and Thermodynamics #Physical chemistry #Physics #Polymer #Reduced viscosity #Relative viscosity #Strong electrolyte #Thermodynamic properties of mixtures #Thermodynamics #Viscosity
- Evidence for Electronic Phase Separation between Orbital Orderings inSmVO3
2005/11/30 by M. H. Sage, Graeme R. Blake, G. R. Blake +2 · 49 citations
Chemistry · Materials Science · Physics and Astronomy · #Advanced Condensed Matter Physics #Antiferromagnetism #Chemistry #Condensed matter physics #Crystallography #Ion #Ionic bonding #Magnetic and transport properties of perovskites and related materials #Materials science #Nuclear physics #Phase (matter) #Physics #Quantum mechanics #Samarium #Solid-state spectroscopy and crystallography #Spins #Vanadium #cond-mat.str-el
- Dye–tissue interactions: mechanisms, quantification and bonding parameters for dyes used in biological staining
2005/01/01 by Richard W. Dapson · 48 citations
Materials Science · Chemistry · Engineering · #Collagen: Extraction and Characterization #Crystallography and molecular interactions #Dyeing and Modifying Textile Fibers #Delocalized electron #Chemical physics #Chemistry #Hydrogen bond #Covalent bond #Ionic bonding #Bond order #Single bond #Computational chemistry #Nanotechnology #Crystallography #Molecule #Materials science #Ion #Organic chemistry #Bond length #Alkyl
- Efficient synthesis of chlorohydrins: ionic liquid promoted ring-opening reaction of epoxides and TMSCl
2004/02/07 by Li‐Wen Xu, Li-Wen Xu, Lyi Li +4 · 42 citations
Chemical Engineering · Chemistry · #Catalysis #Chemical Synthesis and Reactions #Chemistry #Cleavage (geology) #Combinatorial chemistry #Ion #Ionic bonding #Ionic liquid #Ionic liquids properties and applications #Organic chemistry #Ring (chemistry) #Vanadium and Halogenation Chemistry
- Coulomb Crystallization in Expanding Laser-Cooled Neutral Plasmas
2003/11/27 by T. Pohl, Thomas Pohl, Thomas Pattard +3 · 108 citations
Engineering · Physics and Astronomy · #Atomic physics #Coulomb explosion #Dust and Plasma Wave Phenomena #Energetic neutral atom #Ion #Ionic bonding #Ionization #Laser #Laser-induced spectroscopy and plasma #Materials science #Nuclear physics #Optics #Physics #Plasma #Range (aeronautics) #Relaxation (psychology) #Theoretical and Computational Physics #physics.atom-ph #physics.plasm-ph
- Independent Control of Rigidity and Toughness of Polymeric Hydrogels
2003/05/20 by Hyun Joon Kong, Emma Wong, David J. Mooney +1 · 216 citations
Biochemistry, Genetics and Molecular Biology · Chemistry · Engineering · #Advanced Materials and Mechanics #Advanced Sensor and Energy Harvesting Materials #Brittleness #Chemical engineering #Chemistry #Composite material #Covalent bond #Hydrogels: synthesis, properties, applications #Ion #Ionic bonding #Materials science #Organic chemistry #Polymer chemistry #Self-healing hydrogels #Shear modulus #Toughness
- Dynamics of multiply charged ions in intense laser fields
2000/05/15 by S. X. Hu, C. H. Keitel, Christoph H. Keitel · 72 citations
Physics and Astronomy · #Advanced Fiber Laser Technologies #Angular momentum #Atomic physics #Dirac equation #Electron #Ion #Ionic bonding #Laser-Matter Interactions and Applications #Laser-Plasma Interactions and Diagnostics #Physics #Quantum mechanics #quant-ph
- Casein Interactions: Casting Light on the Black Boxes, the Structure in Dairy Products
1998/03/01 by David S. Horne · 600 citations
Agricultural and Biological Sciences · Chemistry · Medicine · #Aqueous solution #Casein #Chemical engineering #Chemical physics #Chemistry #Coagulation #Composite material #Food Allergy and Anaphylaxis Research #Hydrophobic effect #Ion #Ionic bonding #Ionic strength #Materials science #Micelle #Microencapsulation and Drying Processes #Organic chemistry #Proteins in Food Systems #Rennet #Viscoelasticity
- Motion of a particle generated by chemical gradients. Part 2. Electrolytes
1984/11/01 by D. C. Prieve, Dennis C. Prieve, J. L. Anderson +4 · 514 citations
Chemistry · Engineering · #Charged particle #Chemical physics #Chemistry #Chromatography #Counterion #Electric field #Electrolyte #Electrophoresis #Electrostatics and Colloid Interactions #Ion #Ionic bonding #Materials science #Microfluidic and Bio-sensing Technologies #Molecular physics #Nanopore and Nanochannel Transport Studies #Particle (ecology) #Physics #Quantum mechanics #RADIUS
- A HYPOTHESIS RELATING CRITICAL POTASSIUM CONCENTRATIONS FOR GROWTH TO THE DISTRIBUTION AND FUNCTIONS OF THIS ION IN THE PLANT CELL
1984/05/01 by R. A. Leigh, R. G. Wyn Jones · 875 citations
Agricultural and Biological Sciences · Biochemistry, Genetics and Molecular Biology · Chemistry · #Aluminum toxicity and tolerance in plants and animals #Biochemistry #Biology #Biophysics #Botany #Cell wall #Chemistry #Cytoplasm #Ion #Ionic bonding #Magnetic and Electromagnetic Effects #Plant Stress Responses and Tolerance #Plant cell #Plant growth #Potassium #Turgor pressure #Vacuole
- The prediction of mineral solubilities in natural waters: The Na-K-Mg-Ca-H-Cl-SO4-OH-HCO3-CO3-CO2-H2O system to high ionic strengths at 25°C
1984/04/01 by Charles E Harvie, Charles E. Harvie, Nancy Møller +2 · 1,247 citations
Chemical Engineering · Chemistry · Environmental Science · Materials Science · #Activity coefficient #Aqueous solution #Calcium Carbonate Crystallization and Inhibition #Chemical and Physical Properties in Aqueous Solutions #Chemistry #Electrolyte #Electromotive force #Inorganic chemistry #Ion #Ionic bonding #Mine drainage and remediation techniques #Mineral #Organic chemistry #Physical chemistry #Physics #Solubility #Thermodynamics
- Effective coordination numbers (ECoN) and mean Active fictive ionic radii (MEFIR)[1,2]*
1979/01/01 by Rudolf Hoppe · 631 citations
Chemistry · Environmental Science · Materials Science · Mathematics · #Atomic physics #Chemical Synthesis and Characterization #Chemistry #Combinatorics #Coordination number #Crystallography #Ion #Ionic bonding #Ionic radius #Machine Learning in Materials Science #Mathematics #Physics #Quantum mechanics #X-ray Diffraction in Crystallography
- Ionic Radon Solutions
1970/04/17 by Lawrence Stein · 34 citations
Chemistry · #Electrostatics and Colloid Interactions #Radon #Ionic bonding #Chemistry #Environmental science #Environmental chemistry #Physics #Nuclear physics #Ion #Organic chemistry
- On the Non-Orthogonality Problem Connected with the Use of Atomic Wave Functions in the Theory of Molecules and Crystals
1950/03/01 by Per‐Olov Löwdin · 3,188 citations
Chemistry · Mathematics · Physics and Astronomy · #Advanced Chemical Physics Studies #Advanced Physical and Chemical Molecular Interactions #Atomic orbital #Electron #Electron configuration #Geometry #Inorganic Fluorides and Related Compounds #Ion #Ionic bonding #Ionic crystal #Mathematics #Molecular orbital #Molecular orbital theory #Molecule #Orbital overlap #Orthogonality #Physics #Quantum mechanics #Simple (philosophy) #Slater-type orbital #Theoretical physics #Wave function