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Search indexed NASA NTRS and DOE OSTI research on propulsion, heat transfer, battery materials and energy systems. Follow report and document links to the original sources.

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21 records · Page 2

RMCProfile7 : reverse Monte Carlo for multiphase systems

This work introduces a completely rewritten version of the programRMCProfile(version 7), big-box, reverse Monte Carlo modelling software for analysis of total scattering data. The major new feature ofRMCProfile7is the ability to refine multiple phases simultaneously, which is relevant for many current research areas such as energy materials, catalysis and engineering. Other new features include improved support for molecular potentials and rigid-body refinements, as well as multiple different data sets. An empirical resolution correction and calculation of the pair distribution function as a back-Fourier transform are now also available.RMCProfile7is freely available for download at https://rmcprofile.ornl.gov/.

Chemistry↗

Alginate–Amorphous Calcium Carbonate Hydrogels for Controlled Therapeutic Release

Alginate hydrogels are widely explored as biocompatible matrices for transdermal delivery of therapeutic compounds but burst release and mechanical stability remain persistent challenges in drug delivery systems. This experimental study investigated alginate–amorphous calcium carbonate (ACC) hydrogel composites designed to regulate release of model anti-inflammatory compound, ibuprofen. Hydrogels containing 1.6–2.0 wt% sodium alginate were crosslinked with CaCl₂ and combined with ACC through two incorporation pathways: (i) separate addition of ACC and ibuprofen or (ii) co-precipitation of ACC onto ibuprofen prior to hydrogel incorporation. Hydrogels without ACC served as Control. Biocomposite structure and properties were characterized and release profiles quantified using Korsmeyer–Peppas (KP) model.Burst release was curbed as crosslinking time increased, highlighting importance of network density in diffusion control. Co-precipitating ACC with ibuprofen prior to incorporating into the hydrogel suppressed burst release and sustained release for > ~72 h. Rheological measurements indicate ACC reinforces hydrogel network, increasing storage modulus while maintaining hydration and flexibility. KP model indicates release is diffusion-controlled, with deviations reflecting contributions from diffusion barriers and morphologic/structural changes near the ACC coated ibuprofen. ACC within alginate hydrogels provides a strategy for tuning drug release while preserving mechanical properties relevant to transdermal applications.

36 MATERIALS SCIENCE↗

Measurements of Angular Distributions of Drell-Yan Dimuons in $p+p$ and $p+d$ Interactions at 120 GeV/$c$

We present experimental results on the angular distributions of Drell-Yan muons produced by a 120 GeV/$c$ proton beam interacting with liquid hydrogen and deuterium targets. The dimuon angular distributions in both polar ($θ$) and azimuthal ($ϕ$) angles in the Collins-Soper frame are measured within the kinematic range of $4.5 < m_{μμ} < 10\ \mathrm{GeV}/c^2$, $0.19 < p_T < 2.24\ \mathrm{GeV}/c$, and $0 < x_F < 0.95$. Unlike the results of a previous proton-induced Drell-Yan experiment at a higher energy, the data reveal a pronounced $\cos 2ϕ$ modulation in the angular distributions. Comparison with perturbative QCD (pQCD) predictions shows statistically significant deviations, with p-values of 3.5% for the $p+p$ and 1.5% for the $p+d$ Drell-Yan processes. These results suggest the presence of nonperturbative QCD contributions.

Nagai, K. [Christian Brothers U.; Los Alamos; Taiw↗