Search Results - "MATTICE, W. L"

The effect of solid wall interaction on an amorphous polyethylene thin film, using a Monte Carlo simulation on a high coordination lattice by Jang, J.H., Mattice, W.L.

“…A Monte Carlo simulation on a high coordination lattice employing the RIS scheme for short-range interaction and a Lennard–Jones potential for long-range…”
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Atomistic Simulations of Self-Assembled Monolayers That Contain Azobenzene by Xing, L, Mattice, W. L

“…Self-assembled monolayers containing azobenzene groups covalently incorporated into some of the chains are of particular interest because of the…”
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Computer simulation of polyolefin interfaces by Clancy, T.C, Mattice, W.L

“…The surface and interfacial propertis of polymers are of interest attributable to the various technological issues of adhesion, blends, lubrication and…”
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Simulation of the random scission of C–C bonds in the initial stage of the thermal degradation of polyethylene by Doruker, P., Wang, Y., Mattice, W.L.

“…We performed molecular dynamics simulations to analyze the initial stage of the thermal degradation of polyethylene, which is dominated by the random scission…”
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Flexibility of a new thermoplastic polyimide studied with molecular simulations by Zhang, Renshi, Mattice, Wayne L

“…The flexibility of a new thermoplastic polyimide, PI-2, synthesized for 3,3',4,4'-benzophenonetetracarboxylic dianhydride (BTDA) and 2,2-dimethyl-1,…”
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Atomistic Modeling of a New Thermoplastic Polyimide in the Amorphous State: Structure and Energetics by Zhang, Renshi, Mattice, Wayne L

“…Atom-based molecular modeling is conducted for the study of the bulk properties of a recently developed semicrystalline polyimide of…”
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Evaluation of the persistence length of the rigid-rod polymers poly(benzobisoxazole) and poly(benzobisthiazole) using molecular-dynamics simulations by Zhang, Renshi, Mattice, Wayne L

“…Rotational isomeric state theory provides a relatively simple formalism for the evaluation of the persistence vector, a, for a chain that can be represented by…”
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Simulation of Polyethylene Thin Films on a High Coordination Lattice by Doruker, Pemra, Mattice, Wayne L

“…We present the results of some film simulations of polyethylene (PE) on a coarse-grained lattice, which is termed as the second nearest neighbor diamond (2nnd)…”
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Collapsed chains as models for filler particles in a polymer melt by Lin, Heng, Erguney, Fatih, Mattice, Wayne L.

“…Simulations of dense melts of coarse-grained chains have been modified so that they contain filler particles. Since the filler particles and matrix chains are…”
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Mobility of the Surface and Interior of Thin Films Composed of Amorphous Polyethylene by Doruker, Pemra, Mattice, Wayne L.

“…We performed coarse-grained simulations of thin polyethylene films of different thicknesses at 509 K. The films, which present two surfaces to vacuum, are…”
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Reverse Mapping of Coarse-Grained Polyethylene Chains from the Second Nearest Neighbor Diamond Lattice to an Atomistic Model in Continuous Space by Doruker, Pemra, Mattice, Wayne L

“…A high coordination lattice was recently introduced for the simulation of coarse-grained rotational isomeric state (RIS) model chains. This second nearest…”
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Monte Carlo Simulation of Head-to-Head, Tail-to-Tail Polypropylene and Its Mixing with Polyethylene in the Melt by Akten, E. Demet, Mattice, Wayne L

“…Simulations have been performed at 473 K for one-component melts of polyethylene (PE) and head-to-head, tail-to-tail polypropylene (hhPP) as well as a mixture…”
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Estimation of Long-Range Interaction in Coarse-Grained Rotational Isomeric State Polyethylene Chains on a High Coordination Lattice by Cho, Junhan, Mattice, Wayne L

“…A new Monte Carlo simulation on a coarse-grained tetrahedral lattice was recently developed for rotational isomeric state polyethylene chains. The short-range…”
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Molecular dynamics study of the persistence lengths of a new class of polyimide fibers by Zhang, Renshi, Mattice, Wayne L.

“…The transformation matrix method and the concept of virtual bonds has been applied to the study of the persistence lengths of two recently developed polyimide…”
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Temporal Stability of a Bilayer in a Langmuir−Blodgett Multilayer and Its Dependence on Multilayer Structure by Wu, H, Foster, M. D, Ross, S. A, Mattice, W. L, Matties, M. A

“…The stability of a bilayer at or near the surface of a Langmuir−Blodgett multilayer of cadmium arachidate is investigated by fluorescence spectroscopy. Changes…”
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Mixing of Isotactic and Syndiotactic Polypropylenes in the Melt by Clancy, Thomas C, Pütz, Matthias, Weinhold, Jeffrey D, Curro, John G, Mattice, Wayne L

“…The miscibility of polypropylene (PP) melts in which the chains differ only in stereochemical composition has been investigated by two different procedures…”
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Conformation of the cycloalkanes C14H28, C16H32, and C22H44 in the liquid and high-temperature crystalline phases by vibrational spectroscopy by Shannon, V. L, Strauss, H. L, Snyder, Robert G, Elliger, C. A, Mattice, W. L

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Inclusion Complexes of Chain Molecules with Cycloamyloses. 2. Molecular Dynamics Simulations of Polyrotaxanes Formed by Poly(ethylene glycol) and α-Cyclodextrins by Pozuelo, Javier, Mendicuti, Francisco, Mattice, Wayne L

“…Molecular dynamics (MD) simulations were performed for “channel type” polyrotaxanes with α-cyclodextrins (α-CDs) threaded onto monodisperse chains of…”
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Conformational end effects in unperturbed chains and star-branched polymers by Mattice, Wayne L., Helfer, Carin A.

“…End effects in unperturbed chains with a specified number of bonds, n, have previously been characterized using the conformations at individual bonds and the…”
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Strong Solubilization of Small Molecules by Triblock-Copolymer Micelles in Selective Solvents by Xing, Li, Mattice, Wayne L

“…Monte Carlo simulations on a cubic lattice were carried out to study the micellization and solubilization of a system containing ABA triblock copolymers, small…”
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