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At least 757 records · Page 42

COUPLING SMOOTHED PARTICLE HYDRODYNAMICS WITH FINITE ELEMENT METHOD TO SIMULATE RESIDUAL STRESSES FROM FRICTION STIR PROCESSING

Friction stir processing (FSP) is a solid-state material processing technique that locally modifies the microstructure but also induces undesirable residual stresses. A robust numerical model for the FSP can help in mitigating these residual stresses. Heat source models within a finite element method (FEM) framework suffer from inaccuracies. In contrast, smoothed particle hydrodynamics (SPH) model that explicitly captures the material flow near the tool and the associated heat generation are accurate. However, the computational expense of SPH simulations can be prohibitive. In this work, we propose a coupled SPH-FEM framework. SPH is used to model the heat generation accurately near the tool and which is then inserted into to the FEM model as a heat source. To verify this proposed coupling approach, a test case is set up with typical FSP conditions and it is modeled in both SPH and SPH-FEM. The temperatures profiles were compared after the simulations have reached steady-state temperatures. The similarity of the temperature profiles from SPH-FEA and SPH validated the proposed coupling approach. This proposed approach achieves the accuracy of the SPH method while potentially retaining the low computational expense of FEM.

smoothed particle hydrodynamics, Finite Element Me↗

Development of the GEOS-MIT gcm Atmosphere-Ocean Model for Coupled Data Assimilation

During the last two plus decades, The Goddard Earth Observing System (GEOS) and Massachusetts Institute of Technology (MIT) modeling groups have developed, respectively, atmosphere-only and ocean-only global general circulation models. These two models (GEOS and MIT-GCM (General Circulation Model)) have demonstrated their data assimilation capabilities with the recent releases of the Modern Era Reanalysis for Research Applications, Version 2 (MERRA-2) atmospheric reanalysis and the Estimating the Circulation and Climate of the Ocean, Version 4 (ECCO-v4) ocean (and sea ice) state estimate. Independently, the two modeling groups have also produced global atmosphere-only and ocean-only simulations with km-scale grid spacing which proved invaluable for process studies and for the development of satellite and in-situ sampling strategies. Recently, a new effort has been made to couple these two models and to leverage their data-assimilation and high resolution capabilities (i.e., eddy-permitting ocean, cloud-permitting atmosphere). The focus in the model development is put on sub-seasonal to decadal time scales. In this talk, I discuss the new coupled model and present some first coupled simulation results. This will include a high-resolution coupled GEOS-MIT simulation, whereby we have coupled a cubed-sphere-720 (approximately 1/8 degrees) configuration of the GEOS atmosphere to a latitude-longitude-cap-1080 (approximately 1/12 degrees) configuration of the MIT ocean. We compare near-surface diagnostics of this fully coupled ocean-atmosphere set-up to equivalent atmosphere-only and ocean-only simulations. In the comparisons we focus in particular on the differences in air-sea interactions between sea surface temperature (SST) and wind for the coupled and uncoupled simulations.

Strobach, Ehud↗

Simulation of the Onset of the Southeast Asian Monsoon During 1997 and 1998: The Impact of Surface Processes

The onset of the southeast Asian monsoon during 1997 and 1998 was simulated with a coupled mesoscale atmospheric model (MM5) and a detailed land surface model. The rainfall results from the simulations were compared with observed satellite data fiom the TRMM (Tropical Rainfall Measuring Mission) TMI (TRMM Microwave Imager) and GPCP (Global Precipitation Climatology Project). The simulation with the land surface model captured basic signatures of the monsoon onset processes and associated rainfall statistics. The sensitivity tests indicated that land surface processes had a greater impact on the simulated rainfall results than that of a small sea surface temperature change during the onset period. In both the 1997 and 1998 cases, the simulations were significantly improved by including the land surface processes. The results indicated that land surface processes played an important role in modifying the low-level wind field over two major branches of the circulation; the southwest low-level flow over the Indo- China peninsula and the northern cold front intrusion from southern China. The surface sensible and latent heat exchange between the land and atmosphere modified the lowlevel temperature distribution and gradient, and therefore the low-level. The more realistic forcing of the sensible and latent heat from the detailed land surface model improved the monsoon rainfall and associated wind simulation.

Wang, Yansen↗

Simulation of the Onset of the Southeast Asian Monsoon During 1997 and 1998: The Impact of Surface Processes

The onset of the southeast Asian monsoon during 1997 and 1998 was simulated with a coupled mesoscale atmospheric model (MM5) and a detailed land surface model. The rainfall results from the simulations were compared with observed satellite data from the TRMM (Tropical Rainfall Measuring Mission) TMI (TRMM Microwave Imager) and GPCP (Global Precipitation Climatology Project). The simulation with the land surface model captured basic signatures of the monsoon onset processes and associated rainfall statistics. The sensitivity tests indicated that land surface processes had a greater impact on the simulated rainfall results than that of a small sea surface temperature change during the onset period. In both the 1997 and 1998 cases, the simulations were significantly improved by including the land surface processes. The results indicated that land surface processes played an important role in modifying the low-level wind field over two major branches of the circulation; the southwest low-level flow over the Indo-China peninsula and the northern cold front intrusion from southern China. The surface sensible and latent heat exchange between the land and atmosphere modified the low-level temperature distribution and gradient, and therefore the low-level. The more realistic forcing of the sensible and latent heat from the detailed land surface model improved the monsoon rainfall and associated wind simulation. The model results will be compared to the simulation of the 6-7 May 2000 Missouri flash flood event. In addition, the impact of model initialization and land surface treatment on timing, intensity, and location of extreme precipitation will be examined.

Tao, W.-K.↗

Simulation of the Onset of the Southeast Asian Monsoon during 1997 and 1998: The Impact of Surface Processes

The onset of the southeast Asian monsoon during 1997 and 1998 was simulated with a coupled mesoscale atmospheric model (MM5) and a detailed land surface model. The rainfall results from the simulations were compared with observed satellite data from the TRMM (Tropical Rainfall Measuring Mission) TMI (TRMM Microwave Imager) and GPCP (Global Precipitation Climatology Project). The simulation with the land surface model captured basic signatures of the monsoon onset processes and associated rainfall statistics. The sensitivity tests indicated that land surface processes had a greater impact on the simulated rainfall results than that of a small sea surface temperature change during the onset period. In both the 1997 and 1998 cases, the simulations were significantly improved by including the land surface processes. The results indicated that land surface processes played an important role in modifying the low-level wind field over two major branches of the circulation; the southwest low-level flow over the Indo-China peninsula and the northern cold front intrusion from southern China. The surface sensible and latent heat exchange between the land and atmosphere modified the low-level temperature distribution and gradient, and therefore the low-level. The more realistic forcing of the sensible and latent heat from the detailed land surface model improved the monsoon rainfall and associated wind simulation. The model results will be compared to the simulation of the 6-7 May 2000 Missouri flash flood event. In addition, the impact of model initialization and land surface treatment on timing, intensity, and location of extreme precipitation will be examined.

Tao, W.-K.↗

Development of a Coupled Hydrological/Sediment Yield Model for a Watershed at Regional Level

Development of a hydrologic model for the study of environmental conservation requires a comprehensive understanding of individual-storm affecting hydrologic and sedimentologic processes. The hydrologic models that we are currently coupling are the Simulator for Hydrology and Energy Exchange at the Land Surface (SHEELS) and the Distributed Runoff Model (DRUM). SHEELS runs continuously to estimate surface energy fluxes and sub-surface soil water fluxes, while DRUM operates during and following precipitation events to predict surface runoff and peak flow through channel routing. The lateral re-distribution of surface water determined by DRUM is passed to SHEELS, which then adjusts soil water contents throughout the profile. The model SHEELS is well documented in Smith et al. (1993) and Laymen and Crosson (1995). The model DRUM is well documented in Vieux et al. (1990) and Vieux and Gauer (1994). The coupled hydrologic model, SHEELS/DRUM, does not simulate sedimentologic processes. The simulation of the sedimentologic process is important for environmental conservation planning and management. Therefore, we attempted to develop a conceptual frame work for coupling a sediment yield model with SHEELS/DRUM to estimate individual-storm sediment yield from a watershed at a regional level. The sediment yield model that will be used for this study is the Universal Soil Loss Equation (USLE) with some modifications to enable the model to predict individual-storm sediment yield. The predicted sediment yield does not include wind erosion and erosion caused by irrigation and snow melt. Units used for this study are those given by Foster et al. (1981) for SI units.

Rajbhandaril, Narayan↗

Coupling particle scale model and SuperDEM–CFD for multiscale simulation of biomass pyrolysis in a packed bed pyrolyzer

An efficient biomass pyrolysis process requires a comprehensive understanding of the chemical and physical phenomena that occur at multi-length and time scales. In this study, a multiscale computational approach was developed and validated for biomass pyrolysis in a packed-bed reactor by integrating pyrolysis kinetics, a particle scale model, and SuperDEM-CFD in open-source code MFiX. A one-dimensional particle-scale model that discretizes the characteristic length of biomass particle into layers was developed to predict the intraparticle phenomena inside a single particle. The 1D model was validated by comparing it with a single biomass particle pyrolysis experiment. Here, a recently developed SuperDEM-CFD model was employed to simulate the non-spherical particle-particle contact and fluid-particle interaction. The coupled model was applied to simulate the pyrolysis of cubic biomass particles in a packed bed and validated by comparing with experimental data. Simulation with and without particle-scale model was compared, and the effect of the gas-solid heat transfer models was also investigated.

09 BIOMASS FUELS↗

Dynamics and lipid membrane coupling of the RAS-RAF complex revealed via multiscale simulations

To gain molecular and mechanistic insights into initiation of the RAS-RAF signaling cascade, we developed and used a combination of multiscale simulation and experimental approaches. The influence and impact of the membrane on RAS and RAF proteins is a factor we are just beginning to understand and appreciate in more detail. Molecular simulation is an ideal methodology to further study this complicated relationship between the membrane and associated proteins. Our previous work using Multiscale Machine-learned Modeling Infrastructure investigated different lipid compositions solely around the KRAS4b protein and the interplay between protein behavior and these membrane environments. Multiscale Machine-learned Modeling Infrastructure uses machine learning to couple adjacent simulation scales and has been efficiently scaled across some of the world’s largest high-performance computers. Recently, we have expanded this multiresolution framework to include the all-atom simulation scale and to incorporate the RAF RBDCRD domains. Here, we present the overall analysis results from this new simulation campaign comprising a mixture of RAS and RAF RBDCRD proteins. Approximately 35,000 coarse-grained and 10,000 all-atom molecular dynamics simulations were completed, sampled from a variety of protein/lipid composition configurations that were generated from a micron-scale continuum simulation containing hundreds of copies of the proteins. Our studies suggest that orientations of the RAS-RBDCRD complex on the membrane occupy distinct configurational states, and the spatial patterns of lipid arrangements around these different protein states are unique to each state. The extent and size of lipid “fingerprints” imposed on the membrane by the RAS-RBDCRD protein complex are significantly larger than observed for just the RAS protein on its own. These protein complexes strongly associate, but we do not observe statistically significant preferred protein-protein orientations. These observations indicate that spatial colocalization of RAS-RBDCRD proteins in the same vicinity may be assisted by specific membrane environments, acting to increase the probability of signaling complex formation.

Carpenter, Timothy S. [Lawrence Livermore National↗

Vibrations of three-dimensional pipe systems with acoustic coupling

A general algorithm is developed to calculate the beam-type dynamic response of three dimensional multiplane finite length pipe systems, consisting of elbow and straight ducts with continuous interfaces. Emphasis is on secondary acoustic wave effects giving rise to coupling mechanisms; and the simulation accounts for one-dimensional elastoacoustic coupling from a plane acoustic wave and secondary loads resulting from wave asymmetries. The transfer matrix approach is adopted in modeling the elastodynamics of each duct, with allowance for distribution loads. Secondary loads from plane wave distortion are considered with a solution of the Helmholtz equation in an equivalent rigid waveguide, and effects of path imperfection are introduced as a perturbation from the hypothetical perfectly straight pipe. Computations indicate that the one-dimensional acoustic assumption is valid for frequencies below one-half the first cut-off frequency, and the three-dimensional acoustic effects produce an increase in response levels near and above cut-off.

El-Raheb, M.↗

Numerical Study of Combustor-Turbine Interactions Considering a Two-Stage High-Pressure Turbine

In this study, preliminary results are presented from the Open National Combustion Code (OpenNCC) applied to the two-stage high-pressure turbine (HTP) from the energy efficient engine (E3) program. Although the combustor is designed for efficient fuel–air mixing and a relatively uniform exit temperature profile, temporal and spatial variation in combustor exit conditions inevitably lead to hot-streaks in the HPT. These hot streaks can cause local hot spots on the HPT blade surfaces that reduce blade life. To improve understanding of these effects and the overall design of combustor and HPT, we are developing a fully-coupled combustor-turbine computational fluid dynamics (CFD) capability. Previous work has simulated the E^3 combustor at the simulated Sea-Level Take-off (SLTO) condition (P(41) = 2.4 [atm]) with and without the first-stage HPT stator included. This work addresses HPT simulations using inflow conditions based on previous simulation results of the E^3 combustor, as well as investigating the effects of spatial and temporal temperature non-uniformity of the combustor-exit flow on the HPT performance for a more realistic SLTO (P(41) = 27.4 [atm])). First, we analyze existing results from the combustor and the HPT 1st-stage stator simulation, where the unsteady hot gas coming out of the combustor exit travels between the stationary stators and then directly exits the computational domain (i.e., no effect from the rotors). Second, we simulate the HPT including the 1st and 2nd stage stators and rotors with the time-averaged, spatially-nonuniform inflow to the HPT taken from the combustor (with HPT 1st-stage stators) solution. Differences in simulations results for the flow field in the 1st-stage stator region are presented. The results of these two simulations (combustor and HPT simulated in a sequential manner) will be compared to a fully-coupled EEE combustor/HPT simulation to understand the impacts of fully-coupled simulations on combustor and HPT performance for two different operating conditions.

LES↗

Numerical Study of Combustor-Turbine Interactions Considering a Two-Stage High-Pressure Turbine

In this study, preliminary results are presented from the Open National Combustion Code (OpenNCC) applied to the two-stage high-pressure turbine (HTP) from the energy efficient engine (E3) program. Although the combustor is designed for efficient fuel–air mixing and a relatively uniform exit temperature profile, temporal and spatial variation in combustor exit conditions inevitably lead to hot-streaks in the HPT. These hot streaks can cause local hot spots on the HPT blade surfaces that reduce blade life. To improve understanding of these effects and the overall design of combustor and HPT, we are developing a fully-coupled combustor-turbine computational fluid dynamics (CFD) capability. Previous work has simulated the E3 combustor at the simulated Sea-Level Take-off (SLTO) condition (P41 = 2.4 [atm]) with and without the first-stage HPT stator included. This work addresses HPT simulations using inflow conditions based on previous simulation results of the E3 combustor, as well as investigating the effects of spatial and temporal temperature non-uniformity of the combustor-exit flow on the HPT performance for a more realistic SLTO (P41 = 27.4 [atm])). First, we analyze existing results from the combustor and the HPT 1st-stage stator simulation, where the unsteady hot gas coming out of the combustor exit travels between the stationary stators and then directly exits the computational domain (i.e., no effect from the rotors). Second, we simulate the HPT including the 1st and 2nd stage stators and rotors with the time-averaged, spatially-nonuniform inflow to the HPT taken from the combustor (with HPT 1st-stage stators) solution. Differences in simulations results for the flow field in the 1st-stage stator region are presented. The results of these two simulations (combustor and HPT simulated in a sequential manner) will be compared to a fully-coupled EEE combustor/HPT simulation to understand the impacts of fully-coupled simulations on combustor and HPT performance for two different operating conditions.

LES↗

An interface-controlled Mott memristor in α -RuCl 3

Memristor devices have history-dependent charge transport properties that are ideal for neuromorphic computing applications. We reveal a memristor material and mechanism in the layered Mott insulator α-RuCl 3 . The pinched hysteresis loops and S-shaped negative differential resistance in bulk crystals verify memristor behavior and are attributed to a nonlinear coupling between charge injection over a Schottky barrier at the electrical contacts and concurrent Joule heating. Direct simulations of this coupling can reproduce the device characteristics.

Physics↗

Coupling of Charged Particles Via Coulombic Interactions: Numerical Simulations and Resultant Kappa-Like Velocity Space Distribution Functions

A parametric study is performed using the electrostatic simulations of Randol and Christian (2014) in which the number density, n, and initial thermal speed, theta, are varied. The range of parameters covers an extremely broad plasma regime, all the way from the very weak coupling of space plasmas to the very strong coupling of solid plasmas. The first result is that simulations at the same Lambda(sub D), where Lambda(sub D) is the plasma coupling parameter, but at different combinations of n and theta, behave exactly the same. As a function of Lambda(sub D), the form of p(v), the velocity distribution function of v, the magnitude of v, the velocity vector, is studied. For intermediate to high D, heating is observed in p(v) that obeys conservation of energy, and a suprathermal tail is formed, with a spectral index that depends on Lambda(sub D). For strong coupling (Lambda(sub D) much > 1), the form of the tail is v5, consistent with the findings of Randol and Christian (2014). For weak coupling (Lambda(sub D much <1), no acceleration or heating occurs, as there is no free energy. The dependence on N, the number of particles in the simulation, is also explored. There is a subtle dependence in the index of the tail, such that v5 appears to be the N approaches infinity limit.

Randol, Brent M.↗

Life Cycle of Major Sudden Stratospheric Warmings in the Southern Hemisphere from a Multimillennial GCM Simulation

Abstract Sudden stratospheric warmings (SSWs) are rare in the Southern Hemisphere (SH), making it difficult to study possible precursors or subsequent impacts. Using a multimillennial coupled climate model simulation producing 161 SSWs in the SH, we present a detailed study of their life cycle. We show that SH SSWs are predominantly displacement events forced by wave-1 planetary waves, and that a surface signature similar to the negative phase of the Southern Annular Mode (SAM) is detectable up to two months before the onset date, but there is a tendency for a transition from wave 1 before to zonally symmetric anomalies after onset. We identify a strong weakening of the Amundsen Sea low as one of the most prominent precursors, which weakens the climatological wave-2 and wave-3 stationary waves and strengthens wave-1 forcing. Compared to their northern counterparts, SH SSWs generally have a longer time scale, and while there is evidence of pre-onset forcing related to tropical sea surface temperatures, the Indian Ocean dipole is more important than El Niño–Southern Oscillation. Significance Statement Sudden stratospheric warmings (SSWs) are extreme events where the winter polar stratosphere warms within a few days to temperatures usually only experienced in summer. These events are rare in the Southern Hemisphere. Therefore, both the observational record and standard climate model simulations are not enough to understand how SSWs develop, or how they might change surface weather. Here we use very long global climate simulations that produce a large number of SSWs in the Southern Hemisphere to study the development and impact of these events. This includes possible precursors as well as the influence they have on surface weather after they occur.

Meteorology & Atmospheric Sciences↗

Improved pore network models to simulate single-phase flow in porous media by coupling with lattice Boltzmann method

In this paper, different pore network models to simulate single-phase flow in porous media are built and their accuracy is evaluated. In addition to the conventional pore network model (CPNM) which consists of regular pore bodies and throat bonds, three improved pore network models (IPNMs) are developed allowing to better describing the real pore and throat geometry. The first improved pore network model (IPNM1) replaces the regular throat bond with a throat bond showing the real throat cross section. The second improvement (IPNM2) uses a series of sub-throat bonds with varying cross sections to better describe the real throat geometry, which is firstly proposed in this paper. The third model (IPNM3) extracts the real pore-throat-pore geometry without simplification. The conductance of fluid flow through these more realistic throat bonds is calculated by the lattice Boltzmann method (LBM). The accuracy and computational efficiency of the different pore network models are evaluated taking the LBM simulation over the whole porous medium as reference solution. The global permeability and detailed pressure distributions in the pores for the different pore network models are validated. The results show that the accuracy of the pore network model increases from CPNM to IPNM3, but at the expense of increasing computational cost. This study suggests that IPNM3 can replace a whole-domain LBM simulation with similar accuracy but much lower computational cost. As a first-order approximation the newly proposed IPNM2 is suggested as good compromise between accuracy and computational cost.

42 ENGINEERING↗

Hybrid simulation of energetic particles interacting with magnetohydrodynamics using a slow manifold algorithm and GPU acceleration

The hybrid method combining particle-in-cell and magnetohydrodynamics can be used to study the interaction between energetic particles and global plasma modes. In this paper we introduce the M3D-C1-K code, which is developed based on the M3D-C1 finite element code solving the magnetohydrodynamics equations, with a newly developed kinetic module simulating energetic particles. The particle pushing is done using a new algorithm by applying the Boris pusher to the classical Pauli particles to simulate the slow-manifold of particle orbits, with long-term accuracy and fidelity. The particle pushing can be accelerated using GPUs with a significant speedup. The moments of the particles are calculated using the δƒ method, and are coupled into the magnetohydrodynamics simulation through pressure or current coupling schemes. Several linear simulations of magnetohydrodynamics modes driven by energetic particles have been conducted using M3D-C1-K with the δƒ method, including fishbone, toroidal Alfvén eigenmodes and reversed shear Alfvén eigenmodes. Good agreement with previous results from other eigenvalue, kinetic and hybrid codes have been achieved.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗

Analysing the effects of heating and gas puffing in Proto-MPEX helicon and auxiliary heated plasmas

The Material Plasma Exposure Experiment (MPEX) is being constructed at Oak Ridge National Laboratory to investigate critical fusion reactor issues, such as plasma–material interactions (PMIs) under reactor-relevant conditions and time scales. The linear device Proto-MPEX was used as a test bed to address anticipated research and development issues associated with heating scenarios and establish the physics basis for MPEX. The SOLPS-ITER code suite has been applied to understand plasma and neutral transport in Proto-MPEX and to increase confidence in predictive simulations for MPEX. Coupling between COMSOL and SOLPS is performed to implement a 2D electron heating profile of the helicon source. The simulations show reasonable agreement with the experimental data for plasma with helicon and auxiliary electron cyclotron heating (ECH). Both Bohm and constant diffusion (D$_\perp$: 0.5 m 2 s –1 and $\chi_\perp$: 1 m 2 s –1 ) simulations show similar levels of agreement with respect to the sparse experimental data available, assuming a few per cent impurity concentration. ECH significantly increases the target electron temperature, however, the target electron density is reduced compared to helicon-only heated plasmas due to an increase in flow velocity and radial losses. The simulations show that further increasing the ECH power results in an increase in the target electron density due to increased recycling flux and ionization. The results indicate that ECH significantly enhances the target heat flux, with ECH power of 50 kW increasing the target heat flux from 0.4 to 17 MW m –2 . It is found that a small amount of gas puffing (GP) near the target plate can further increase the target heat fluxes at the higher ECH power cases, but the target heat flux is reduced at higher GP conditions due to a significant reduction in electron temperature via radiation. ECH and GP scenarios can generate a higher target flux, facilitating improved PMI studies with more reactor-relevant plasma conditions.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗

A Parameterization of the Cloud Scattering Polarization Signal Derived From GPM Observations for Microwave Fast Radative Transfer Models

Microwave cloud polarized observations have shown the potential to improve precipitation retrievals since they are linked to the orientation and shape of ice habits. Stratiform clouds show larger brightness temperature (TB) polarization differences (PDs), defined as the vertically polarized TB (TBV) minus the horizontally polarized TB (TBH), with ~10 K PD values at 89 GHz due to the presence of horizontally aligned snowflakes, while convective regions show smaller PD signals, as graupel and/or hail in the updraft tend to become randomly oriented. The launch of the global precipitation measurement (GPM) microwave imager (GMI) has extended the availability of microwave polarized observations to higher frequencies (166 GHz) in the tropics and midlatitudes, previously only available up to 89 GHz. This study analyzes one year of GMI observations to explore further the previously reported stable relationship between the PD and the observed TBs at 89 and 166 GHz, respectively. The latitudinal and seasonal variability is analyzed to propose a cloud scattering polarization parameterization of the PD-TB relationship, capable of reconstructing the PD signal from simulated TBs. Given that operational radiative transfer (RT) models do not currently simulate the cloud polarized signals, this is an alternative and simple solution to exploit the large number of cloud polarized observations available. Finally, the atmospheric radiative transfer simulator (ARTS) is coupled with the weather research and forecasting (WRF) model, in order to apply the proposed parameterization to the RT simulated TBs and hence infer the corresponding PD values, which show to reproduce the observed GMI PDs well.

54 ENVIRONMENTAL SCIENCES↗