372 research outputs found
Shear Alignment and Instability of Smectic Phases
We consider the shear flow of well-aligned one-component smectic phases, such
as thermotropic smectics and lamellar diblock copolymers, below the critical
region. We show that, as a result of thermal fluctuations of the layers,
parallel () alignment is generically unstable and perpendicular ()
alignment is stable against long-wavelength undulations. We also find,
surprisingly, that both and are stable for a narrow window of values
for the anisotropic viscosity.Comment: To appear in PRL. Revtex, 1 figure
Temperature dependence in interatomic potentials and an improved potential for Ti
The process of deriving an interatomic potentials represents an attempt to
integrate out the electronic degrees of freedom from the full quantum
description of a condensed matter system. In practice it is the derivatives of
the interatomic potentials which are used in molecular dynamics, as a model for
the forces on a system. These forces should be the derivative of the free
energy of the electronic system, which includes contributions from the entropy
of the electronic states. This free energy is weakly temperature dependent, and
although this can be safely neglected in many cases there are some systems
where the electronic entropy plays a significant role. Here a method is
proposed to incorporate electronic entropy in the Sommerfeld approximation into
empirical potentials. The method is applied as a correction to an existing
potential for titanium. Thermal properties of the new model are calculated, and
a simple method for fixing the melting point and solid-solid phase transition
temperature for existing models fitted to zero temperature data is presented.Comment: CCP 201
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Evaluation of permanent alopecia in pediatric medulloblastoma patients treated with proton radiation
Background: To precisely calculate skin dose and thus to evaluate the relationship between the skin dose and permanent alopecia for pediatric medulloblastoma patients treated with proton beams. Methods: The dosimetry and alopecia outcomes of 12 children with medulloblastoma (ages 4-15 years) comprise the study cohort. Permanent alopecia was assessed and graded after completion of the entire therapy. Skin threshold doses of permanent alopecia were calculated based on the skin dose from the craniospinal irradiation (CSI) plan using the concept of generalized equivalent uniform dose (gEUD) and accounting for chemotherapy intensity. Monte Carlo simulations were employed to accurately assess uncertainties due to beam range prediction and secondary particles. Results: Increasing the dose of the CSI field or the dose given by the boost field to the posterior fossa increased total skin dose delivered in that region. It was found that permanent alopecia could be correlated with CSI dose with a threshold of about 21 Gy (relative biological effectiveness, RBE) with high dose chemotherapy and 30 Gy (RBE) with conventional chemotherapy. Conclusions: Our results based on 12 patients provide a relationship between the skin dose and permanent alopecia for pediatric medulloblastoma patients treated with protons. The alopecia risk as assessed with gEUD could be predicted based on the treatment plan information
Oscillatory Shear Flow-Induced Alignment of Lamellar Melts of Hydrogen-Bonded Comb Copolymer Supramolecules
In this work we present the orientational behavior of comb copolymer-like supramolecules P4VP(PDP)1.0, obtained by hydrogen bonding between poly(4-vinylpyridine) and pentadecylphenol, during large-amplitude oscillatory shear flow experiments over a broad range of frequencies (0.001-10 Hz). The alignment diagram, presenting the macroscopic alignment in T/TODT vs Ï/Ïc, contains three regions of parallel alignment separated by a region of perpendicular alignment. For our material, the order-disorder temperature TODT = 67 °C and Ïc, the frequency above which the distortion of the chain conformation dominates the materialsâ viscoelasticity, is around 0.1 Hz at 61 °C. For the first time flipping from a pure transverse alignment via biaxial transverse/perpendicular alignment to a perpendicular alignment as a function of the strain amplitude was found.
Polymer and spherical nanoparticle diffusion in nanocomposites
Nanoparticle and polymer dynamics in nanocomposites containing spherical nanoparticles were investigated by means of molecular dynamics simulations. We show that the polymer diffusivity decreases with nanoparticle loading due to an increase of the interfacial area created by nanoparticles, in the polymer matrix. We show that small sized nanoparticles can diffuse much faster than that predicted from the Stokes-Einstein relation in the dilute regime. We show that the nanoparticle diffusivity decreases at higher nanoparticle loading due to nanoparticle-polymer interface. Increase of the nanoparticle radius slows the nanoparticle diffusion
Pharmacokinetic and behavioral characterization of a longterm antipsychotic delivery system in rodents and rabbits
Rationale: Non-adherence with medication remains the major correctable cause of poor outcome in schizophrenia. However, few treatments have addressed this major determinant of outcome with novel long-term delivery systems.
Objectives: The aim of this study was to provide biological proof of concept for a long-term implantable antipsychotic delivery system in rodents and rabbits.
Materials and methods: Implantable formulations of haloperidol were created using biodegradable polymers. Implants were characterized for in vitro release and in vivo behavior using prepulse inhibition of startle in rats and mice, as well as pharmacokinetics in rabbits.
Results: Behavioral measures demonstrate the effectiveness of haloperidol implants delivering 1 mg/kg in mice and 0.6 mg/kg in rats to block amphetamine (10 mg/kg) in mice or apomorphine (0.5 mg/kg) in rats. Additionally, we demonstrate the pattern of release from single polymer implants for 1 year in rabbits.
Conclusions: The current study suggests that implantable formulations are a viable approach to providing long-term delivery of antipsychotic medications in vivo using animal models of behavior and pharmacokinetics. In contrast to depot formulations, implantable formulations could last 6 months or longer. Additionally, implants can be removed throughout the delivery interval, offering a degree of reversibility not available with depot formulations
Ordering of the lamellar phase under a shear flow
The dynamics of a system quenched into a state with lamellar order and
subject to an uniform shear flow is solved in the large-N limit. The
description is based on the Brazovskii free-energy and the evolution follows a
convection-diffusion equation. Lamellae order preferentially with the normal
along the vorticity direction. Typical lengths grow as (with
logarithmic corrections) in the flow direction and logarithmically in the shear
direction. Dynamical scaling holds in the two-dimensional case while it is
violated in D=3
Phase Separation of Rigid-Rod Suspensions in Shear Flow
We analyze the behavior of a suspension of rigid rod-like particles in shear
flow using a modified version of the Doi model, and construct diagrams for
phase coexistence under conditions of constant imposed stress and constant
imposed strain rate, among paranematic, flow-aligning nematic, and log-rolling
nematic states. We calculate the effective constitutive relations that would be
measured through the regime of phase separation into shear bands. We calculate
phase coexistence by examining the stability of interfacial steady states and
find a wide range of possible ``phase'' behaviors.Comment: 23 pages 19 figures, revised version to be published in Physical
Review
Production of haloperidol-loaded PLGA nanoparticles for extended controlled drug release of haloperidol
Nature of Viscoelasticity in Lamellar Block Copolymers: Contraction Correlated to Strain Localization
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