Related papers: Steinberg-Guinan strength model for rhenium
Metallic glasses are frequently used as structural materials. Therefore, it is important to develop methods to predict their mechanical response as a function of the microstructure prior to loading. We develop a coarse-grained spring…
A nanostructured trigonal SnSe2 was produced by mechanical alloying, and the effect of high-pressures up to 25.8 GPa on it was investigated. The literature reports refined structural data for SnS2 for pressures up to 20 GPa. These data were…
Rhenium diboride is a recently recognized ultra-incompressible superhard material. Here we report the electronic (e), phonon (p), e-p coupling and thermal properties of ReB$_2$ from first-principles density-functional theory (DFT)…
We study the rheology of dry and wet granular materials in the steady quasistatic regime using the Discrete Element Method (DEM) in a split-bottom ring shear cell with focus on the macroscopic friction. The aim of our study is to understand…
In recent years, the paradigm of `soft glassy matter' has been used to describe diverse nonergodic materials exhibiting strong local disorder and slow mesoscopic rearrangement. As so far formulated, however, the resulting `soft glassy…
Calibrating and verifying crystal plasticity material models is a significant challenge, particularly for materials with a number of potential slip and twin systems. Here we use digital image correlation on coarse-grained $\alpha$-uranium…
Flexible graphite (FG) with 1 - 1.2 g/cm$^3$ density is employed as beam energy absorber material in the CERN's Large Hadron Collider (LHC) beam dumping system. However, the increase of energy deposited expected for new HL-LHC…
The paper proposes a theoretical approach to modeling the key characteristics of highly efficient gallium arsenide-based solar cells (SCs), using a one-dimensional SC model. The following recombination mechanisms are considered in the…
This research develops and evaluates machine learning models to predict the mechanical properties of steel-polypropylene fiber-reinforced high-performance concrete (HPC). Three model families were investigated: Extra Trees with XGBoost…
Constructing an accurate atomistic model for the high-pressure phases of tin (Sn) is challenging because properties of Sn are sensitive to pressures. We develop machine-learning-based deep potentials for Sn with pressures ranging from 0 to…
Finite element analysis of stress about a blunt crack tip, emphasizing finite strain and phenomenological and mechanism-based strain gradient plasticity (SGP) formulations, is integrated with electrochemical assessment of occluded-crack tip…
Hypothesis: While the mechanical disruption of microscopic structures in complex fluids by large shear flows has been studied extensively, the effects of applied strains on the dielectric properties of macromolecular aggregates has received…
In the pursuit of developing high-temperature alloys with improved properties for meeting the performance requirements of next-generation energy and aerospace demands, integrated computational materials engineering (ICME) has played a…
We study the onset of rigidity near the glass transition (GT) in a short-chain polymer melt modelled by a bead-spring model, where all beads interact with Lennard-Jones potentials. The properties of the system are examined above and below…
We present a first principle scheme to compute the rigidity, i. e. the shear-modulus of structural glasses at finite temperatures using the cloned liquid theory, which combines the replica theory and the liquid theory. With the aid of the…
A gas-driven permeation (GDP) platform, SHIELD (Salt-compatible Hydrogen barrier Investigation and EvaLuation for fusion Devices), has been developed to measure hydrogen transport properties in structural materials under controlled thermal…
This work presents a Euler-Bernoulli beam finite element (FE) model to study the interlayer interaction mechanics of graphene nanoribbon (GNR) over a graphene substrate. The FE model is calibrated using molecular dynamics (MD) simulations…
With increasing interest in the use of glassy carbon (GC) for a wide variety of application areas, the need for developing fundamental understanding of its mechanical properties has come to the forefront. Further, recent theoretical and…
Detectors based on liquid or gas xenon have been used and are in use for a number of applications, in particular for the detection of gamma rays. Xenon is a well-suited medium for gamma spectroscopy thanks to its high atomic number and,…
Fluidized granular media have a rich rheology: measuring shear stress $\sigma$ as a function of shear rate $\dot\gamma$, they exhibit Newtonian behavior $\sigma\sim\dot\gamma$ for low densities and shear rates, develop a yield stress for…