Amalie Frischknecht
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Amalie Frischknecht's Degrees
- Masters Computer Science Stanford University
- Bachelors Computer Science University of California, Berkeley
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(Suggest an Edit or Addition)According to Wikipedia, Amalie L. Frischknecht is an American theoretical polymer physicist at Sandia National Laboratories in Albuquerque, New Mexico. She was elected a fellow of the American Physical Society in 2012 for "her outstanding contributions to the theory of ionomers and nanocomposites including the development and application of density functional theory to polymers". Her research focuses on understanding the structure, phase behavior, and self-assembly of polymer systems, such as complex fluids polymer nanocomposites, lipid bilayer assemblies, and ionomers.
Amalie Frischknecht's Published Works
Published Works
- Ionic aggregate structure in ionomer melts: effect of molecular architecture on aggregates and the ionomer peak. (2012) (129)
- Nanorod Assemblies in Polymer Films and Their Dispersion-Dependent Optical Properties. (2012) (86)
- Dispersion of Polymer-Grafted Nanorods in Homopolymer Films: Theory and Experiment (2013) (83)
- Dynamics of Model Ionomer Melts of Various Architectures (2012) (81)
- Rheology of Three-Arm Asymmetric Star Polymer Melts (2002) (76)
- Direct Comparisons of X-ray Scattering and Atomistic Molecular Dynamics Simulations for Precise Acid Copolymers and Ionomers (2015) (73)
- Numerical challenges in the application of density functional theory to biology and nanotechnology (2002) (68)
- Effect of polymer architecture and ionic aggregation on the scattering peak in model ionomers. (2011) (66)
- Phase behavior of polymer/nanoparticle blends near a substrate. (2008) (64)
- Using arbitrary trial distributions to improve intramolecular sampling in configurational-bias Monte Carlo (2006) (59)
- Surface-induced first-order transition in athermal polymer-nanoparticle blends. (2007) (58)
- Atomistic Simulations Predict a Surprising Variety of Morphologies in Precise Ionomers. (2013) (58)
- Expanded chain dimensions in polymer melts with nanoparticle fillers. (2010) (58)
- Influence of Cation Type on Ionic Aggregates in Precise Ionomers (2013) (55)
- Density functional theory for inhomogeneous polymer systems. II. Application to block copolymer thin films (2002) (48)
- Improved United Atom Force Field for Poly(dimethylsiloxane) (2003) (48)
- Structure and Dynamics of Coarse-Grained Ionomer Melts in an External Electric Field (2015) (47)
- Impact of Hydration and Sulfonation on the Morphology and Ionic Conductivity of Sulfonated Poly(phenylene) Proton Exchange Membranes (2019) (44)
- Forces between nanorods with end-adsorbed chains in a homopolymer melt. (2008) (41)
- Density functional theory for inhomogeneous polymer systems. I. Numerical methods (2002) (39)
- Exploring Lateral Microphase Separation in Mixed Polymer Brushes by Experiment and Self-Consistent Field Theory Simulations (2012) (39)
- Effect of Chain Stiffness on Nanoparticle Segregation in Polymer/Nanoparticle Blends Near a Substrate (2012) (37)
- Electrical double layers and differential capacitance in molten salts from density functional theory. (2014) (30)
- Stability of cylindrical domains in phase-separating binary fluids in shear flow (1998) (28)
- Surface-induced phase behavior of polymer/nanoparticle blends with attractions. (2012) (28)
- Simulation of the Adsorption of Nucleotide Monophosphates on Carbon Nanotubes in Aqueous Solution (2008) (27)
- Self-consistent field simulations of self- and directed-assembly in a mixed polymer brush (2011) (26)
- Density functional theory approach for coarse-grained lipid bilayers. (2005) (26)
- Alcohols reduce lateral membrane pressures: predictions from molecular theory. (2006) (25)
- Microphase Boundaries and Chain Conformations in Multiply Branched Diblock Copolymers (1999) (24)
- Origin of Mechanical Enhancement in Polymer Nanoparticle (NP) Composites with Ultrahigh NP Loading (2020) (24)
- Two- and three-body interactions among nanoparticles in a polymer melt. (2011) (22)
- Nanoscale Structure and Morphology of Sulfonated Polyphenylenes via Atomistic Simulations (2017) (21)
- Fluctuation Effects on the Brush Structure of Mixed Brush Nanoparticles in Solution. (2018) (20)
- Diffusion with Contour Length Fluctuations in Linear Polymer Melts (2000) (20)
- Chain and Ion Dynamics in Precise Polyethylene Ionomers (2019) (19)
- Calculation of Entropic Terms Governing Nanoparticle Self-Assembly in Polymer Films (2008) (19)
- Phase Behavior of Grafted Polymer Nanocomposites from Field-Based Simulations (2019) (18)
- Self-Diffusion with Dynamic Dilution in Star Polymer Melts (2000) (17)
- Heterogeneous Chain Dynamics and Aggregate Lifetimes in Precise Acid-Containing Polyethylenes: Experiments and Simulations (2016) (17)
- Toward Quantitative Coarse-Grained Models of Lipids with Fluids Density Functional Theory. (2012) (17)
- Hydrogen-bonded aggregates in precise acid copolymers. (2014) (17)
- Modeling Microscopic Morphology and Mechanical Properties of Block Copolymer/Nanoparticle Composites (2009) (16)
- The evolution of acidic and ionic aggregates in ionomers during microsecond simulations. (2019) (16)
- The structure of poly(ethylene oxide) liquids: comparison of integral equation theory with molecular dynamics simulations and neutron scattering (2005) (15)
- Comparison of density functional theory and simulation of fluid bilayers. (2005) (15)
- Self-assembly in a mixed polymer brush with inhomogeneous grafting density composition (2013) (15)
- Quantifying Single-Ion Transport in Percolated Ionic Aggregates of Polymer Melts. (2020) (14)
- Morphology and proton diffusion in a coarse-grained model of sulfonated poly(phenylenes). (2019) (13)
- Charged Nanoparticle Attraction in Multivalent Salt Solution: A Classical-Fluids Density Functional Theory and Molecular Dynamics Study. (2016) (13)
- Comparison of Field-Theoretic Approaches in Predicting Polymer Nanocomposite Phase Behavior (2017) (13)
- Model for the aggregation state of living anionic polymers (2001) (13)
- Nonequilibrium simulations of model ionomers in an oscillating electric field. (2016) (12)
- Three-dimensional liquid surfaces through nanoparticle self-assembly (2010) (12)
- Phase Behavior of Ternary Polymer Brushes. (2016) (12)
- Simulation of a small molecule analogue of a lithium ionomer in an external electric field. (2014) (12)
- Percolated Ionic Aggregate Morphologies and Decoupled Ion Transport in Precise Sulfonated Polymers Synthesized by Ring-Opening Metathesis Polymerization (2020) (12)
- Heterogeneous Coordination Environments in Lithium-Neutralized Ionomers Identified Using 1H and 7Li MAS NMR (2012) (12)
- Orientational Control of Polymer Grafted Nanorods (2016) (11)
- Computational investigations of pore forming peptide assemblies in lipid bilayers. (2006) (11)
- Electrostatics of Nanoparticle–Wall Interactions within Nanochannels: Role of Double-Layer Structure and Ion–Ion Correlations (2017) (10)
- Effect of shear flow on the stability of domains in two-dimensional phase-separating binary fluids (1997) (9)
- Chain and Segmental Dynamics in Polymer–Nanoparticle Composites with High Nanoparticle Loading (2021) (9)
- Hydrophilic domain structure in polymer exchange membranes: Simulations of NMR spin diffusion experiments to address ability for model discrimination (2018) (9)
- Comparison of random-walk density functional theory to simulation for bead-spring homopolymer melts. (2004) (8)
- Fluorine-Free Precise Polymer Electrolyte for Efficient Proton Transport: Experiments and Simulations (2021) (8)
- Effect of surface properties and polymer chain length on polymer adsorption in solution. (2021) (8)
- Linear rheology of binary melts from a phenomenological tube model of entangled polymers (2002) (7)
- Morphology and Dynamics in Hydroxide-Conducting Polysulfones (2022) (6)
- Solvation Energy of Ions in a Stockmayer Fluid. (2020) (6)
- Modeling Thermal Abuse in Transportation Batteries (2012) (5)
- Density Functional Theory and Molecular Dynamics Simulation of Poly(dimethylsiloxane) Melts near Silica Surfaces (2005) (5)
- High-pressure hydrogen decompression in sulfur crosslinked elastomers (2022) (4)
- Binary fluid with attractions near a planar wall. (2010) (4)
- Activated pathways for the directed insertion of patterned nanoparticles into polymer membranes. (2013) (4)
- Electrostatically tuned self-assembly of branched amphiphilic peptides. (2014) (3)
- The origin of mechanical enhancement in polymer nanoparticle composites with ultra-high nanoparticle loading. (2019) (3)
- NMR spin diffusion measurements in disordered polymers: Insights and limitations (2019) (3)
- Why the anisotropic planar rotor model is nearly second order (2001) (2)
- Grafted Low Molecular Weight Polymers as Steric Stabilizers of Commercial Titania Nanoparticles in Polydimethylsiloxane Fluids (2010) (2)
- Subdiffusive High-Pressure Hydrogen Gas Dynamics in Elastomers (2022) (2)
- Field-theoretic Simulations of Block Copolymers: Design and Solvent Annealing (2012) (2)
- Self-Assembled Vesicles from Mixed Brush Nanoparticles in Solution (2021) (2)
- THE ANHARMONIC BENDING VIBRATION OF THE NACL DIMER (1998) (2)
- Correction to Dispersion of Polymer-Grafted Nanorods in Homopolymer Films: Theory and Experiment (2013) (1)
- Field-based simulations of directed self-assembly in a mixed brush system (2010) (1)
- Phase Behavior of Polymer-Grafted Nanoparticles in a Polymer Melt. (2021) (1)
- A Curated Experimental Compilation Analyzed by Theory Is More than a Review (2020) (1)
- Molecular Self-Assembly (2001) (1)
- Phase Behavior of Polymer-Grafted Nanoparticles in Homopolymer Blends from Simulations (2022) (1)
- Amphiphilic triblocks to control assembly of mixed or segregated bilayers and monolayers. (2015) (1)
- A hybrid, coupled approach for modeling charged fluids from the nano to the mesoscale (2017) (1)
- Solution behavior of PEO : the ultimate biocompatible polymer. (2004) (1)
- Effects of Morphology on Ion Transport in Ionomers for Energy Storage (2012) (1)
- Forces between nanorods with end-adsorbed chains in polymer melts (2008) (1)
- Microphase Separation of Mixed Polymer Brushes: An Experimental and Theoretical Exploration of Phase Behavior. (2011) (1)
- Aggregate dynamics in ionomer melts (2018) (0)
- Mechanism of Ion Diffusion in Coarse-Grained Ionomer Melts (2013) (0)
- Mixed Polymer Brushes: A Tool for Nano-lithography? (2010) (0)
- Molecular dynamics simulations of ionic aggregates in a coarse-grained ionomer melt (2011) (0)
- Directed nanoparticle assembly in 3D liquid films (2009) (0)
- Molecular Dynamics Simulation of Diffusivity and Mobility of Ionic Charge Carriers in Model Battery Polymers (2012) (0)
- Phase behavior of polymer/nanoparticle blends with attractions near a substrate (2010) (0)
- Ordering in Mixed Polymer Brushes (2015) (0)
- Molecular Theory Studies of Polymer/Nanoparticle Blends Near Surfaces (2007) (0)
- Erratum: Hydrophilic Domain Structure in Polymer Exchange Membranes: Simulations of NMR Spin Diffusion Experiments to Address Ability for Model Discrimination (2019) (0)
- Phase Behavior of Polymer-Grafted Nanoparticles. (2021) (0)
- H-Mat: Task P2 (SNL) Computational Polymer modeling Accomplishments. (2022) (0)
- Chain Expansion in Polymer-Nanoparticle Melts (2009) (0)
- Density Functional Theory and MD Simulations of Properties of PDMS near Silica Surfaces (2005) (0)
- Ion transport and aggregate morphology in precise sulfophenylated polyethylene ionomers (2019) (0)
- Final Report: LDRD Project 79824 Carbon Nanotube Sorting via DNA-Directed Self-Assembly (2007) (0)
- Nanoparticle interactions in electrolyte solutions: A classical density functional theory and molecular dynamics study (2016) (0)
- Nanoparticle Simulations & Theory. (2015) (0)
- Dynamics and morphologies of course-grained ionomer melts under an external electric field (2014) (0)
- Nanoparticle Dispersant Design and Suspension Rheological Properties. (2008) (0)
- Quantifying the brush structure and assembly of mixed brush nanoparticles in solution (2017) (0)
- Electrostatics of Particle Confinement within Nanochannels: Role of Double-Layer Interactions and Ion-Ion Correlations (2017) (0)
- Conformational changes of chain molecules on an adsorbing substrate: Solvent and temperature effects. (2006) (0)
- Effects of alcohols on lipid bilayers from molecular theory. (2006) (0)
- Morphology and Ion Transport in Hydrated Ion-Containing Polymers. (2021) (0)
- Towards a Scalable Multifidelity Simulation Approach for Electrokinetic Problems at the Mesoscale (2017) (0)
- Classical Density Functional Theory of Charged Fluids at Interfaces. (2015) (0)
- Self-assembled chains of polymer-grafted nanorods. (2015) (0)
- Rheology of Nanoparticle/Polymer Mixtures. (2007) (0)
- NMR Spin Diffusion Experiments and Simulations for Model Discrimination and Ionic Domain Size Measurements in Proton Exchange Membranes (2018) (0)
- Phase Behavior of Polymer-Grafted Nanoparticles in a Binary Polymer Melt. (2021) (0)
- Morphology and Conductivity in Sulfonated Polyphenylenes (2019) (0)
- Chain Dynamics in Li-neutralized Precise Acid-Containing Polyethylenes (2018) (0)
- Improved United Atom Force Field and Surface Structure of Poly(dimethylsiloxane) Melts (2003) (0)
- Final report :LDRD project 84269 supramolecular structures of peptide-wrapped carbon nanotubes. (2006) (0)
- Resolving fundamental limits of adhesive bonding in microfabrication. (2004) (0)
- Bio-inspired nanocomposite assemblies as smart skin components. (2011) (0)
- Rheology of Asymmetric Star Polymer Melts (2001) (0)
- Ionic aggregation and counterion dynamics in model ionomers. (2011) (0)
- SAND 2001 – 3417 Unlimited Release Printed November 2001 Molecular Self-Assembly LDRD Project : 32573 Final Report (2001) (0)
- Nonequilibrium Simulations of Ion Dynamics in Ionomer Melts (2016) (0)
- Atomistic Materials Modeling of High-Pressure Hydrogen Interactions in Ethylene Propylene Diene Monomer (EPDM) Rubber. (2022) (0)
- Structure and Dynamics of Hydrated Precise Sulfophenylated Polyethylene Polymers from Simulation. (2021) (0)
- Explicit Polarization in Coarse-Grained Simulations of Ionomer Melts (2022) (0)
- Ion Dynamics in Model Ionomer Melts as a Function of Polymer Architecture (2012) (0)
- Simulations of Coarse-Grained Ionomer Melts in an External Electric Field. (2014) (0)
- Effects of alcohols and pore-forming peptides on lipid bilayers. (2007) (0)
- Surrogate molecular dynamics simulation model for dielectric constants with ensemble neural networks (2022) (0)
- Pursuing Ordered Microphase Separation in Mixed Polymer Brushes. (2014) (0)
- Bulk and Interfacial Behavior of Nano\-particle/Polymer Blends (2005) (0)
- Microphase Separation of Ternary and Diblock Binary Polymer Brushes. (2015) (0)
- Stabilization of nanorods in polymer melts by end-adsorbed chains. (2007) (0)
- Structure and elastic properties of lipid bilayers from molecular theory and MD simulation. (2005) (0)
- Comparison of density functional theory to simulation for freely-jointed chains. (2004) (0)
- The directed insertion of Janus nanoparticles into polymer membranes. (2013) (0)
- Molecular Theory Applied to Lipid Bilayers and Lipid–Protein Interactions (2009) (0)
- Simulation of Ion Transport through Percolated Aggregates in Precise Sulfophenylated Polyethylene Ionomers (2020) (0)
- Dynamics of Precise Ethylene-Acrylic Acid Copolymers and Ionomers Using Dielectric Spectroscopy (2014) (0)
- Dispersion of Polymer-Grafted Nanorods in Polymer Films (2013) (0)
- Molecular dynamics simulations of diffusion and aggregation in an ionomer melt. (2010) (0)
- Robust Three Dimensional Liquid Films through Nanoparticle Assembly (2009) (0)
- Mechanisms of Ion Diffusion as a Function of Microstructure in Ionomer Melts (2019) (0)
- Atomistic EPDM Simulations with Silica Filler. (2021) (0)
- Morphology and Aggregate Local Structure of Precise Polyolefins with Associating Pendant Groups (2013) (0)
- Electrostatics of Colloidal Particles Confined in Nanochannels: Role of Double-Layer Interactions and Ion-Ion Correlations (2017) (0)
- Local Dynamics of Acid- and Ion-containing Copolymer Melts. (2016) (0)
- Atomistic Simulations of Aggregation in Ionomer Melts (2014) (0)
- Entropically Driven Layering Near a Substrate: A Fluids DFT Study (2008) (0)
- (Invited) Structure and Dynamics in Ion-Conducting Polymers from MD Simulations (2018) (0)
- Dispersion of titania nanoparticles in polydimethylsiloxane fluids using grafted low molecular weight polymers. (2008) (0)
- Dispersion and Alignment of CdSe Nanorods in Polymer Nanocomposites (2014) (0)
- Self-assembled chains of polymer-grafted nanorods in homopolymer films (2015) (0)
- Simulation of Ionic Aggregation and Ion Dynamics in Model Ionomers (2012) (0)
- Triblock Polymers for Nanoporous Membranes (2012) (0)
- Viscosity of ``Nanoparticle''/Polymer Mixtures (2007) (0)
- Proton transport through acid aggregates in a hydrated precise sulfophenylated polyethylene (2019) (0)
- Ionic Aggregate Morphologies in Precise Ionomers. (2013) (0)
- Understanding Morphology and Proton Transport in Sulfonated Poly(Phenylenes) (2018) (0)
- A New Picture of Ionomer Structure and Dynamics. (2014) (0)
- Coarse-Grained Lipids II : a comparison of density functional theory and simulation. (2004) (0)
- Molecular dynamics simulations of ionic aggregates in a coarse%3CU%2B2010%3Egrained ionomer melt. (2010) (0)
- Three-body Interactions in Polymer Nanocomposites (2010) (0)
- Using advanced field-based approaches to predict macroscale polymer nanocomposite phase behavior (2019) (0)
- Unexpected Thermomechanical Behavior of Off-Stoichiometry Epoxy/Amine Materials (2023) (0)
- Coarse grained ionomer melts under an external electric field. (2014) (0)
- Development of a model colloidal system for rheology simulation. (2008) (0)
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