- Electrostatics of salt-dependent reentrant phase behaviors highlights diverse roles of ATP in biomolecular condensates
2024/01/10 by Yi-Hsuan Lin, Yi‐Hsuan Lin, Tae Hun Kim +10 · 2 citations
Biochemistry, Genetics and Molecular Biology · Chemistry · Engineering · Materials Science · #Biology #Biophysics #Chemical physics #Chemistry #Condensed matter physics #Electrical engineering #Electrostatics #Engineering #Enzyme Structure and Function #Materials science #Nanotechnology #Phase (matter) #Physics #Protein Structure and Dynamics #RNA Research and Splicing #Reentrancy #Salt (chemistry) #Static electricity
- q-pac : A Python package for machine learned charge equilibration models
2023/08/02 by Martin Vondrák, Karsten Reuter, Johannes T. Margraf · 6 citations
Chemistry · Computer Science · Materials Science · Mathematics · #Charge (physics) #Chemical physics #Chemistry #Computational Drug Discovery Methods #Computational science #Computer science #Discrete mathematics #Electrochemical Analysis and Applications #Electronegativity #Electrostatics #Kernel (algebra) #Machine Learning in Materials Science #Materials science #Mathematics #Physical chemistry #Physics #Programming language #Python (programming language) #Quantum mechanics #Range (aeronautics) #Representation (politics) #Statistical physics
- Polyelectrolyte Complexation of Two Oppositely Charged Symmetric Polymers: A Minimal Theory
2021/11/24 by Soumik Mitra, Mitra, Soumik, Arindam Kundagrami +1 · 1 citation
Chemistry · Materials Science · #Chemical physics #Chemistry #Computational chemistry #Coulomb #Counterion #Electric potential energy #Electrostatics #Electrostatics and Colloid Interactions #Enthalpy #Entropy (arrow of time) #FOS: Physical sciences #Ion #Organic chemistry #Physical chemistry #Physics #Polyelectrolyte #Polymer #Polymer Surface Interaction Studies #Quantum mechanics #Soft Condensed Matter (cond-mat.soft) #Static electricity #Surfactants and Colloidal Systems #Thermodynamics
- Overcharging and charge inversion: Finding the correct explanation(s)
2019/10/20 by Wiebe M. de Vos, Saskia Lindhoud · 10 citations
Chemistry · Engineering · Materials Science · #Charge (physics) #Chemical physics #Chemistry #Electrostatics #Electrostatics and Colloid Interactions #Geology #Inversion (geology) #Ion #Microfluidic and Capillary Electrophoresis Applications #Physics #Polymer Surface Interaction Studies #Quantum mechanics #Statistical physics #Theoretical physics
- The long-range attraction between hydrophobic macroscopic surfaces
2019/06/07 by Patrick Kékicheff · 3 citations
Chemistry · Energy · Environmental Science · #Adsorption #Aqueous solution #Chemical physics #Chemistry #Classical mechanics #Debye length #Electrostatics #Electrostatics and Colloid Interactions #Geometry #Hydrophobic effect #Ion #Ionic bonding #Ionic strength #Iron oxide chemistry and applications #London dispersion force #Minerals Flotation and Separation Techniques #Molecule #Monolayer #Physical chemistry #Physics #Scaling #Surface force #Surface forces apparatus #van der Waals force
- Electrostatics of solvated systems in periodic boundary conditions
2014/10/29 by Oliviero Andreussi, Nicola Marzari · 1 citation
Chemistry · Mathematics · Physics and Astronomy · #Advanced Chemical Physics Studies #Boundary (topology) #Boundary value problem #Classical mechanics #Computer science #Dielectric #Electrostatics #Embedding #Ion #Mathematical analysis #Mathematics #Periodic boundary conditions #Photochemistry and Electron Transfer Studies #Physics #Quantum #Quantum mechanics #Solvation #Space (punctuation) #Spectroscopy and Quantum Chemical Studies #Statistical physics #cond-mat.mtrl-sci #physics.chem-ph
- Building Water Models: A Different Approach
2014/08/07 by Saeed Izadi, Ramu Anandakrishnan, Alexey V. Onufriev · 1 citation
Biochemistry, Genetics and Molecular Biology · Mathematics · Physics and Astronomy · #Charge (physics) #Classical mechanics #Computer science #Electrostatics #Geometry #Materials science #Mathematics #Mean squared error #Molecular dynamics #Physics #Point (geometry) #Point particle #Protein Structure and Dynamics #Quantum mechanics #Range (aeronautics) #Set (abstract data type) #Spectroscopy and Quantum Chemical Studies #Statistical physics #Statistics #Symmetry (geometry) #Theoretical and Computational Physics #Water model #physics.bio-ph #physics.chem-ph #physics.comp-ph
- State-dependent electrostatic interactions of S4 arginines with E1 in S2 during Kv7.1 activation
2010/05/17 by Dick Wu, Kelli Delaloye, Mark A. Zaydman +3 · 26 citations
Biochemistry, Genetics and Molecular Biology · Chemistry · Medicine · Neuroscience · #Biochemistry #Biology #Biophysics #Cardiac electrophysiology and arrhythmias #Chemistry #Electrostatics #Gating #Gene #Ion channel regulation and function #Membrane #Membrane potential #Mutation #Neuroscience and Neural Engineering #Transmembrane domain
- Dressed counterions: Strong electrostatic coupling in the presence of salt
2009/12/31 by Matej Kanduc, Matej Kanduč, Ali Naji +2 · 1 citation
Chemistry · Earth and Planetary Sciences · Mathematics · Physics and Astronomy · #Chemical physics #Chemistry #Counterion #Coupling (piping) #Debye length #Electrochemical Analysis and Applications #Electrolyte #Electrostatics #Electrostatics and Colloid Interactions #Geophysical and Geoelectrical Methods #Ion #Materials science #Mathematics #Monte Carlo method #Physical chemistry #Physics #Quantum mechanics #Salt (chemistry) #Statistical physics #cond-mat.soft #cond-mat.stat-mech
- Amorphous silica modeled with truncated and screened Coulomb interactions: A molecular dynamics simulation study
2007/07/02 by Antoine Carré, Ludovic Berthier, Juergen Horbach +3 · 1 citation
Chemistry · Materials Science · Physics and Astronomy · #Amorphous solid #Charge (physics) #Chemistry #Coulomb #Crystallography #Cutoff #Electron #Electrostatics #Ewald summation #Glass properties and applications #Material Dynamics and Properties #Materials science #Molecular dynamics #Physics #Quantum mechanics #Range (aeronautics) #Spectroscopy and Quantum Chemical Studies #Statistical physics #Yukawa potential #cond-mat.stat-mech
- Is the Ewald summation still necessary? Pairwise alternatives to the accepted standard for long-range electrostatics
2006/06/19 by Christopher J. Fennell, J. Daniel Gezelter · 42 citations
Biochemistry, Genetics and Molecular Biology · Engineering · Mathematics · Physics and Astronomy · #Classical mechanics #Cutoff #Electrostatics #Ewald summation #Lattice (music) #Materials science #Mathematics #Molecular dynamics #Nanopore and Nanochannel Transport Studies #Pairwise comparison #Physics #Protein Structure and Dynamics #Quantum mechanics #Range (aeronautics) #Spectroscopy and Quantum Chemical Studies #Statistical physics
- Multiscale coarse graining of liquid-state systems
2005/09/29 by Sergei Izvekov, Gregory A. Voth · 50 citations
Chemistry · Materials Science · Physics and Astronomy · #Block Copolymer Self-Assembly #Chemical physics #Chemistry #Computational chemistry #Computer science #Electrostatics #Force field (fiction) #Granularity #Material Dynamics and Properties #Molecular dynamics #Physical chemistry #Physics #Representation (politics) #Statistical physics #Theoretical and Computational Physics #Virial theorem #Water model
- Electrostatic interactions in strongly coupled soft matter
2005/01/14 by Ali Naji, Swetlana Jungblut, André G. Moreira +2 · 3 citations
Chemistry · Earth and Planetary Sciences · Materials Science · Physics and Astronomy · #Charge (physics) #Charged particle #Chemical physics #Chemistry #Classical mechanics #Colloid #Composite material #Counterion #Coupling (piping) #Electrostatic interaction #Electrostatics #Electrostatics and Colloid Interactions #Geophysical and Geoelectrical Methods #Ion #Material Dynamics and Properties #Materials science #Particle (ecology) #Physics #Planar #Quantum mechanics #Soft matter #Valency #cond-mat.soft #cond-mat.stat-mech
- Nanoelectromechanics of piezoresponse force microscopy
2004/08/10 by Sergei V. Kalinin, Edgar Karapetian, E. Karapetian +1 · 1 citation
Chemistry · Engineering · Mathematics · Physics and Astronomy · #Acoustic Wave Resonator Technologies #Adhesion, Friction, and Surface Interactions #Atomic force acoustic microscopy #Atomic force microscopy #Chemistry #Classical mechanics #Composite material #Condensed matter physics #Electric field #Electrostatic force microscope #Electrostatics #Ferroelectricity #Field (mathematics) #Force Microscopy Techniques and Applications #Indentation #Magnetic field #Magnetic force microscope #Materials science #Mathematics #Mechanics #Nanotechnology #Optoelectronics #Physics #Piezoelectricity #Piezoresponse force microscopy #Point particle #Polarization (electrochemistry) #Quantum mechanics #cond-mat.mtrl-sci
- Cationic DMPC/DMTAP Lipid Bilayers: Molecular Dynamics Study
2003/12/16 by A. A. Gurtovenko, Andrey A. Gurtovenko, Michael Patra +2 · 1 citation
Biochemistry, Genetics and Molecular Biology · Chemistry · Engineering · Physics and Astronomy · #Bilayer #Biochemistry #Cationic polymerization #Chemical physics #Chemistry #Computational chemistry #Crystallography #Electrostatics #Ion #Lipid Membrane Structure and Behavior #Lipid bilayer #Lipid bilayer phase behavior #Membrane #Mole fraction #Molecular dynamics #Nanopore and Nanochannel Transport Studies #Organic chemistry #Physical chemistry #RNA Interference and Gene Delivery #cond-mat.soft #physics.bio-ph #q-bio.BM
- Effective charge saturation in colloidal suspensions
2002/10/09 by Lyderic Bocquet, Lydéric Bocquet, Emmanuel Trizac +1 · 3 citations
Chemistry · Materials Science · Physics and Astronomy · #Charge (physics) #Colloid #Colloidal particle #Electrolyte #Electrostatics #Electrostatics and Colloid Interactions #Material Dynamics and Properties #Nonlinear system #Polyelectrolyte #Renormalization #Saturation (graph theory) #Spectroscopy and Quantum Chemical Studies #cond-mat.soft
- Long-range electrostatic interactions between like-charged colloids: Steric and confinement effects
1999/09/29 by E. Trizac, Emmanuel Trizac, Jean-Luc Raimbault +1 · 2 citations
Chemistry · Earth and Planetary Sciences · Engineering · Mathematics · Physics and Astronomy · #Boltzmann constant #Charge (physics) #Chemical physics #Chemistry #Colloid #Electrolyte #Electrostatic interaction #Electrostatics #Electrostatics and Colloid Interactions #Geophysical and Geoelectrical Methods #Ion #Materials science #Mathematics #Microfluidic and Bio-sensing Technologies #Physical chemistry #Physics #Poisson distribution #Poisson–Boltzmann equation #Quantum mechanics #Range (aeronautics) #Statistical physics #Steric effects #cond-mat.soft #cond-mat.stat-mech
- A thermo-electric model of material removal during electric discharge machining
1999/04/01 by Ajit Singh, Ajit Pal Singh, Amitabha Ghosh · 1 citation
Chemistry · Engineering · #Advanced Machining and Optimization Techniques #Advanced Surface Polishing Techniques #Advanced machining processes and optimization #Chemistry #Composite material #Electric discharge #Electrical discharge machining #Electrical engineering #Electrode #Electrostatic discharge #Electrostatics #Engineering #Machining #Materials science #Mechanics #Metal #Metallurgy #Physics #Voltage #Yield (engineering)
- Polyelectrolyte electrostatics: Salt dependence, entropic, and enthalpic contributions to free energy in the nonlinear Poisson–Boltzmann model
1995/08/01 by Kim A. Sharp · 13 citations
Chemistry · Materials Science · #Chemical physics #Chemistry #Counterion #Donnan potential #Electrolyte #Electrostatics #Electrostatics and Colloid Interactions #Ion #Material Dynamics and Properties #Organic chemistry #Physical chemistry #Physics #Poisson–Boltzmann equation #Polyelectrolyte #Polymer #Surfactants and Colloidal Systems #Thermodynamics
- Extracting electrical energy from the vacuum by cohesion of charged foliated conductors
1984/08/15 by Robert L. Forward · 1 citation
Physics and Astronomy · Engineering · #Quantum Electrodynamics and Casimir Effect #Experimental and Theoretical Physics Studies #Thermal Radiation and Cooling Technologies #Casimir effect #Casimir pressure #Physics #Electrical conductor #Conductor #Electric potential energy #Electrostatic force microscope #Electric field #Electric charge #Vacuum energy #Electrostatics #Electron #Condensed matter physics #Quantum electrodynamics #Classical mechanics #Energy (signal processing) #Quantum mechanics #Materials science #Nanotechnology #Atomic force microscopy
- Dipole moment fluctuation formulas in computer simulations of polar systems
1983/11/01 by Martin Neumann, M. Neumann · 42 citations
Chemistry · Engineering · Materials Science · Mathematics · Physics and Astronomy · #Advanced Chemical Physics Studies #Boundary value problem #Chemical and Physical Properties of Materials #Chemistry #Classical mechanics #Dielectric #Dipole #Electrostatics #Ewald summation #Field (mathematics) #Mathematics #Molecular dynamics #Moment (physics) #Muon and positron interactions and applications #Periodic boundary conditions #Physical chemistry #Physics #Polar #Polarization (electrochemistry) #Quantum mechanics #Thermodynamics