Search results for "Simulation"
showing 10 items of 5095 documents
SPATIAL MULTIFRACTALITY OF ELECTRONIC STATES AND THE METAL-INSULATOR TRANSITION IN DISORDERED SYSTEMS
1993
For the investigation of the spatial behavior of electronic wave functions in disordered systems, we employ the Anderson model of localization. The eigenstates of the corresponding Hamiltonian are calculated numerically by means of the Lanczos algorithm and are analyzed with respect to their spatial multifractal properties. We find that the wave functions show spatial multifractality for all parameter cases not too far away from the metal-insulator transition (MIT) which separates localized from extended states in this model. Exactly at the MIT, multifractality is expected to exist on all length scales larger than the lattice spacing. It is found that the corresponding singularity spectrum…
Common fixed points in cone metric spaces for CJM-pairs
2011
Abstract In this paper we introduce some contractive conditions of Meir–Keeler type for two mappings, called f - M K -pair mappings and f - C J M -pair (from Ciric, Jachymski, and Matkowski) mappings, in the framework of regular cone metric spaces and we prove theorems which guarantee the existence and uniqueness of common fixed points. We give also a fixed point result for a multivalued mapping that satisfies a contractive condition of Meir–Keeler type. These results extend and generalize some recent results from the literature. To conclude the paper, we extend our main result to non-regular cone metric spaces by using the scalarization method of Du.
The Study of Carbamoyl Phosphate Synthetase 1 Deficiency Sheds Light on the Mechanism for Switching On/Off the Urea Cycle
2015
12 páginas, 4 figuras, 2 tablas.
Decipher the mechanisms of protein conformational changes induced by nucleotide binding through free-energy landscape analysis: ATP binding to Hsp70.
2013
ATP regulates the function of many proteins in the cell by transducing its binding and hydrolysis energies into protein conformational changes by mechanisms which are challenging to identify at the atomic scale. Based on molecular dynamics (MD) simulations, a method is proposed to analyze the structural changes induced by ATP binding to a protein by computing the effective free-energy landscape (FEL) of a subset of its coordinates along its amino-acid sequence. The method is applied to characterize the mechanism by which the binding of ATP to the nucleotide-binding domain (NBD) of Hsp70 propagates a signal to its substrate-binding domain (SBD). Unbiased MD simulations were performed for Hsp…
Chebyshev’s Method on Projective Fluids
2020
We demonstrate the acceleration potential of the Chebyshev semi-iterative approach for fluid simulations in Projective Dynamics. The Chebyshev approach has been successfully tested for deformable bodies, where the dynamical system behaves relatively linearly, even though Projective Dynamics, in general, is fundamentally nonlinear. The results for more complex constraints, like fluids, with a particular nonlinear dynamical system, remained unknown so far. We follow a method describing particle-based fluids in Projective Dynamics while replacing the Conjugate Gradient solver with Chebyshev’s method. Our results show that Chebyshev’s method can be successfully applied to fluids and potentially…
A Microsimulation-Based Modelling Approach for Connected and Automated Vehicles on Roundabouts
2023
Connectivity and automation are technologies applied in combination to achieve increases in road safety, traffic efficiency and energy savings. Despite their potential, there are still many open questions regarding how roadway capacity will be affected and what methods should be employed to assess the expected benefits in the transportation domain. In this paper “what-if” scenarios were modelled in Aimsun Next to analyse assumption-based behaviour of automated vehicles operating with a cooperative adaptive cruise control system on roundabouts. The idea behind the study comes from the availability of the capacity adjustment factors for connected and automated vehicles provided by the Highway…
Fine-Mesh Numerical Simulations for 2D Riemann Problems with a Multilevel Scheme
2001
The numerical simulation of physical problems modeled by systems of conservation laws can be difficult due to the occurrence of discontinuities and other non-smooth features in the solution.
Approximate Lax–Wendroff discontinuous Galerkin methods for hyperbolic conservation laws
2017
Abstract The Lax–Wendroff time discretization is an alternative method to the popular total variation diminishing Runge–Kutta time discretization of discontinuous Galerkin schemes for the numerical solution of hyperbolic conservation laws. The resulting fully discrete schemes are known as LWDG and RKDG methods, respectively. Although LWDG methods are in general more compact and efficient than RKDG methods of comparable order of accuracy, the formulation of LWDG methods involves the successive computation of exact flux derivatives. This procedure allows one to construct schemes of arbitrary formal order of accuracy in space and time. A new approximation procedure avoids the computation of ex…
Adaptive mesh refinement techniques for high-order shock capturing schemes for multi-dimensional hydrodynamic simulations
2006
The numerical simulation of physical phenomena represented by non-linear hyperbolic systems of conservation laws presents specific difficulties mainly due to the presence of discontinuities in the solution. State of the art methods for the solution of such equations involve high resolution shock capturing schemes, which are able to produce sharp profiles at the discontinuities and high accuracy in smooth regions, together with some kind of grid adaption, which reduces the computational cost by using finer grids near the discontinuities and coarser grids in smooth regions. The combination of both techniques presents intrinsic numerical and programming difficulties. In this work we present a …
Flotation with sedimentation: Steady states and numerical simulation of transient operation
2020
Abstract A spatially one-dimensional model of the hydrodynamics of a flotation column is based on one continuous phase, the fluid, and two disperse phases: the aggregates, that is, bubbles with attached hydrophobic valuable particles, and the solid particles that form the gangue. A common feed inlet for slurry mixture and gas is considered and the bubbles are assumed to be fully aggregated with hydrophobic particles as they enter the column. The conservation law of the three phases yields a model expressed as a system of partial differential equations where the nonlinear constitutive flux functions come from the drift-flux and solids-flux theories. In addition, the total flux functions are …