Search Results - "Budzien, Joanne"

Using Hydrodynamic Similarity as a Verification Method for Impact Cratering Simulations in the FLAG Hydrocode by Holmes, Matthew C., Caldwell, Wendy K., Budzien, Joanne L., Johnson, Carl E.

“…Abstract Hydrodynamic codes (hydrocodes) are common tools for modeling hypervelocity impacts to provide insight into the physical phenomenon. Hydrocodes can…”
Get full text

Molecular Dynamics Simulations of Polymer Networks Undergoing Sequential Cross-Linking and Scission Reactions by Rottach, Dana R, Curro, John G, Budzien, Joanne, Grest, Gary S, Svaneborg, Carsten, Everaers, Ralf

“…The effects of sequential cross-linking and scission of polymer networks formed in two states of strain are investigated using molecular dynamics simulations…”
Get full text

Reactive Molecular Dynamics Simulations of Shock Through a Single Crystal of Pentaerythritol Tetranitrate by Budzien, Joanne, Thompson, Aidan P, Zybin, Sergey V

“…Large-scale molecular dynamics simulations and the reactive force field ReaxFF were used to study shock-induced initiation in crystalline pentaerythritol…”
Get full text

On the Mechanism of Ion Transport through Polyphosphazene Solid Polymer Electrolytes:  NMR, IR, and Raman Spectroscopic Studies and Computational Analysis of 15N-Labeled Polyphosphazenes by Luther, Thomas A, Stewart, Frederick F, Budzien, Joanne L, LaViolette, Randall A, Bauer, William F, Harrup, Mason K, Allen, Christopher W, Elayan, Azzam

“…Comprehensive investigation of lithium ion complexation with 15N-labeled polyphosphazenes 15 N-poly[bis(2-(2-methoxyethoxy)ethoxy)phosphazene] (15 N-MEEP) and…”
Get full text

Solubility of Gases in Amorphous Polyethylene by Budzien, Joanne L, McCoy, John D, Weinkauf, Donald H, LaViolette, Randall A, Peterson, Eric S

“…The hypothetical polyethylene melt at room temperature is of interest for the purposes of developing the atomic level modeling of gas solubilities in rubbery…”
Get full text

The Solubility of Gases in Polyethylene:  Integral Equation Study of Standard Molecular Models by Budzien, Joanne L, McCoy, John D, Curro, John G, LaViolette, Randall A, Peterson, Eric S

“…The solubility coefficients of a wide range of gases in polyethylene were calculated with a recently developed integral equation theory of gas solubility…”
Get full text

The Solubility of Gases in Polyethylene:  Integral Equation Study of Standard Molecular Models Volume 31, Number 19, September 22, 1998, p 6669 by Budzien, Joanne L, McCoy, John D, Curro, John G, LaViolette, Randall A, Peterson, Eric S

Get full text

Permanent Set of Cross-Linking Networks:  Comparison of Theory with Molecular Dynamics Simulations by Rottach, Dana R, Curro, John G, Budzien, Joanne, Grest, Gary S, Svaneborg, Carsten, Everaers, Ralf

“…The permanent set of cross-linking networks is studied by molecular dynamics. The uniaxial stress for a bead−spring polymer network is investigated as a…”
Get full text

A New Constitutive Model for the Chemical Aging of Rubber Networks in Deformed States by Budzien, Joanne, Rottach, Dana R, Curro, John G, Lo, Chi S, Thompson, Aidan P

“…This paper describes the finite element implementation of a recently developed constitutive model for the chemical aging of rubber in deformed states. The…”
Get full text

A New Constitutive Model for the Chemical Aging of Polymer Networks in Deformed States by Budzien, Joanne Louise, Lo, Chi S., Thompson, Aidan P., Rottach, Dana R., Curro, John G.

Get full text

Effects of chain stiffness and penetrant size on penetrant diffusion in simple polymers: deduced relations from simulation and PRISM theory by Budzien, Joanne, McCoy, John D., Rottach, Dana, Curro, John G.

“…Molecular dynamics simulations in the NVT ensemble were performed for a repulsive system of bead-spring polymer chains with angle constraints. The diffusion…”
Get full text

Ab initio Molecular Dynamics Simulations of the Initial Stages of Solid-electrolyte Interphase Formation on Lithium Ion Battery Graphitic Anodes by Leung, Kevin, Budzien, Joanne

“…Physical Chemistry Chemical Physics, 2010, 12, 6583-6586 The decomposition of ethylene carbonate (EC) during the initial growth of solid-electrolyte interphase…”
Get full text

On the Mechanism of Ion Transport through Polyphosphazene Solid Polymer Electrolytes:  NMR, IR, and Raman Spectroscopic Studies and Computational Analysis of 15 N-Labeled Polyphosphazenes by Luther, Thomas A., Stewart, Frederick F., Budzien, Joanne L., LaViolette, Randall A., Bauer, William F., Harrup, Mason K., Allen, Christopher W., Elayan, Azzam

Get full text

On the Mechanism of Ion Transport through Polyphosphazene Solid Polymer Electrolytes 1: NMR, IR, and Raman Spectroscopic Studies and Computational Analysis of 15N Labeled Polyphosphazenes by Luther, Thomas Alan, Stewart, Frederick Forrest, Budzien, Joanne Louise, Laviolette, Randall Alexander, Bauer, William Francis, Harrup, Mason Kurt, Allen, Charles Anthony, Elayan, A.

“…Comprehensive investigation of lithium ion complexation with 15N-labeled polyphosphazenes- 15N-poly[bis(2-(2-methoxyethoxy)ethoxy)phosphazene] (15N-MEEP) and…”
Get full text

Reactive Molecular Dynamics of Shock- and Shear-Induced Chemistry in Energetic Materials for Future Force Insensitive Munitions by Zybin, Sergey V, Goddard, William A, Peng Xu, Budzien, Joanne, Thompson, Aidan

“…We report an approach to large-scale atomistic simulations of chemical initiation processes in shocked energetic materials based on parallel implementation of…”
Get full text