FEASST is an open-source Monte Carlo software package for particle-based simulations. This software, which was released in 2017, has been used to study phase equilibrium, self-assembly, aggregation or gelation in biological materials, colloids, polymers, ionic liquids, and adsorption in porous networks. We highlight some of the unique features available in FEASST, such as flat-histogram grand canonical ensemble, Gibbs ensemble, and Mayer-sampling simulations with support for anisotropic models and parallelization with flat-histogram and prefetching. We also discuss how the challenges of supporting a variety of Monte Carlo algorithms were overcome by an object-oriented design. This also allows others to extend classes, which improves software interoperability, as inspired by LAMMPS classes and user packages. This article describes version 0.25.1 with benchmarks, compilation instructions, and introductory tutorials for running, restarting, and testing simulations, user guidelines, software design strategies, alternative interfaces, and the test-driven development strategy.
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http://dx.doi.org/10.1063/5.0224283 | DOI Listing |
Appl Radiat Isot
January 2025
Tokyo City University, 1-28-1, Tamazutsumi, Setagaya-ku, Tokyo, 158-8557, Japan.
In clearance measurements involving a single material type, a conversion factor was applied to convert measurement results to activity based on an assumed uniform density. However, this factor has been found to underestimate activity in material mixtures. In this study, we proposed a method to identify the location with the lowest detection sensitivity (minimum location) in a mixture and evaluated its applicability to the conversion factor.
View Article and Find Full Text PDFPhys Med
January 2025
IRCCS San Raffaele Scientific Institute, Experimental Imaging Center, Milan, Italy. Electronic address:
Purpose: Minibeam radiotherapy (MBRT) uses small parallel beams of radiation to create a highly modulated dose pattern. The aim of this study is to develop an optical radioluminescence imaging (RLI) approach to perform real-time dose measurement for MBRT.
Methods: MBRT was delivered using an image-guided small animal irradiator equipped with a custom collimator.
BMC Oral Health
January 2025
Division of Fixed Prosthodontics, Conservative Dentistry Department, Faculty of Dentistry, Alexandria University, Alexandria, Egypt.
Background: Increasing demand for durable and aesthetically pleasing dental restorations, including laminates, inlays, onlays, and crowns, has led to advancements in all-ceramic systems, particularly with the development of advanced lithium disilicate materials. However, limited data on the fit accuracy and fracture resistance of these materials restricts their wider application in clinical restorative practices.
Aim Of The Study: This in vitro study aims to compare the marginal and internal fit, assess the fracture resistance, and evaluate the failure modes of crowns fabricated from advanced and conventional lithium disilicate materials.
Ecotoxicol Environ Saf
January 2025
Beijing Key Laboratory of Farmland Soil Pollution Prevention and Remediation, Key Laboratory of Plant-Soil Interactions of the Ministry of Education, College of Resources and Environmental Sciences, China Agricultural University, Beijing 100193, PR China. Electronic address:
A comprehensive understanding of cadmium (Cd) migration in soils near contaminated hotspots is crucial for optimizing remediation efforts and ensuring crop health. This study investigates agricultural soils from four sites in mining and sewage-irrigation areas, assessing the impact of inorganic and organic fertilizer application on soil Cd remobilization. Results revealed that fertilization, particularly with mineral phosphorus, disrupts soil stability, substantially increases short-term Cd mobility in vulnerable regions.
View Article and Find Full Text PDFAppl Radiat Isot
January 2025
Institute of Health and Medical Technology, Hefei Institutes of Physical Science, Chinese Academy of Sciences, Hefei, Anhui, 230031, China. Electronic address:
This study investigated the influence of tissue electron density on proton beam dose distribution using TOPAS Monte Carlo simulation. Heterogeneous tissue models composed of 14 materials were constructed to simulate the dose deposition process of a 169.23 MeV proton beam.
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