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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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At least 991 records · Page 55
All sourcesNASA NTRSDOE OSTI
DOE OSTI2015

SU-E-T-256: Development of a Monte Carlo-Based Dose-Calculation System in a Cloud Environment for IMRT and VMAT Dosimetric Verification

Purpose: Intensity-modulated radiation therapy (IMRT) and volumetric-modulated arc therapy (VMAT) are techniques that are widely used for treating cancer due to better target coverage and critical structure sparing. The increasing complexity of IMRT and VMAT plans leads to decreases in dose calculation accuracy. Monte Carlo simulations are the most accurate method for the determination of dose distributions in patients. However, the simulation settings for modeling an accurate treatment head are very complex and time consuming. The purpose of this work is to report our implementation of a simple Monte Carlo simulation system in a cloud-computing environment for dosimetric verification of IMRT and VMAT plans. Methods: Monte Carlo simulations of a Varian Clinac linear accelerator were performed using the BEAMnrc code, and dose distributions were calculated using the DOSXYZnrc code. Input files for the simulations were automatically generated from DICOM RT files by the developed web application. We therefore must only upload the DICOM RT files through the web interface, and the simulations are run in the cloud. The calculated dose distributions were exported to RT Dose files that can be downloaded through the web interface. The accuracy of the calculated dose distribution was verified by dose measurements. Results: IMRT and VMAT simulations were performed and good agreement results were observed for measured and MC dose comparison. Gamma analysis with a 3% dose and 3 mm DTA criteria shows a mean gamma index value of 95% for the studied cases. Conclusion: A Monte Carlo-based dose calculation system has been successfully implemented in a cloud environment. The developed system can be used for independent dose verification of IMRT and VMAT plans in routine clinical practice. The system will also be helpful for improving accuracy in beam modeling and dose calculation in treatment planning systems. This work was supported by JSPS KAKENHI Grant Number 25861057.

60 APPLIED LIFE SCIENCES↗
DOE OSTI2023

Measuring Galactic dark matter through unsupervised machine learning

ABSTRACT Measuring the density profile of dark matter in the Solar neighbourhood has important implications for both dark matter theory and experiment. In this work, we apply autoregressive flows to stars from a realistic simulation of a Milky Way-type galaxy to learn – in an unsupervised way – the stellar phase space density and its derivatives. With these as inputs, and under the assumption of dynamic equilibrium, the gravitational acceleration field and mass density can be calculated directly from the Boltzmann equation without the need to assume either cylindrical symmetry or specific functional forms for the galaxy’s mass density. We demonstrate our approach can accurately reconstruct the mass density and acceleration profiles of the simulated galaxy, even in the presence of Gaia-like errors in the kinematic measurements.

Astronomy & Astrophysics↗
DOE OSTI2014

Raising gradient limitations in 2.1 GHz superconducting photonic band gap accelerator cavities

We report results from recent 2.1 GHz superconducting radio frequency (SRF) photonic band gap (PBG) resonator experiments at Los Alamos. Two 2.1 GHz PBG cells with elliptical rods were fabricated and tested at high power in a liquid helium bath at the temperatures of 4 K and below 2 K. The described SRF PBG cells were designed with a particular emphasis on changing the shape of the PBG rods to reduce peak surface magnetic fields and at the same time to preserve its effectiveness at damping higher-order-modes. The superconducting PBG cavities have great potential for damping long-range wakefields in SRF accelerator structures without affecting the fundamental accelerating mode. The cells performed in accordance with simulation's predictions and the maximum achieved accelerating gradient was 18.3 MV/m. This represents a 30% increase over gradients previously demonstrated in superconducting PBG cavities with round rods.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2020

Accelerating high-strain continuum-scale brittle fracture simulations with machine learning

Failure in brittle materials under dynamic loading conditions is a result of the propagation and coalescence of microcracks. Simulating this discrete crack evolution at the continuum level is computationally expensive or, in some cases, intractable, resulting in the need to make broad assumptions or neglect key physics. In this work, we have developed an approach using machine learning that overcomes the current inability to represent meso-scale physics at the macro-scale. Our approach leverages damage and stress data from a computationally expensive high-fidelity model that explicitly resolves microcrack behavior to build an inexpensive machine learning emulator. Once trained, the machine learning emulator is used to predict the evolution of crack length statistics, which then informs a continuum-scale constitutive model. This results in a significant speed-up of the workflow by four orders of magnitude. Both the machine learning emulator and the continuum-scale model are validated against the high-fidelity model and experimental data, respectively, showing excellent agreement. There are two key findings. The first is that we can reduce the dimensionality of the problem, establishing that the machine learning emulator only needs the length of the longest crack and one of the maximum stress components to capture the necessary physics. Another compelling finding is that the emulator can be trained in one experimental setting and transferred successfully to predict behavior in a different setting.

36 MATERIALS SCIENCE↗
DOE OSTI2025

MBX V1.2: Accelerating Data-Driven Many-Body Molecular Dynamics Simulations

The MBX software provides an advanced platform for molecular dynamics simulations, leveraging state-of-the-art MB-pol and MB-nrg data-driven many-body potential energy functions. Developed over the past decade, these potential energy functions integrate physics-based and machine-learned many-body terms trained on electronic structure data calculated at the "gold standard" coupled-cluster level of theory. Recent advancements in MBX have focused on optimizing its performance, resulting in the release of MBX v1.2. While the inherently many-body nature of MB-pol and MB-nrg ensures high accuracy, it poses computational challenges. MBX v1.2 addresses these challenges with significant performance improvements, including enhanced parallelism that fully harnesses the power of modern multicore CPUs. In conclusion, these advancements enable simulations on nanosecond time scales for condensed-phase systems, significantly expanding the scope of high-accuracy, predictive simulations of complex molecular systems powered by data-driven many-body potential energy functions.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2023

Dephasingless laser wakefield acceleration in the bubble regime

Abstract Laser wakefield accelerators (LWFAs) have electric fields that are orders of magnitude larger than those of conventional accelerators, promising an attractive, small-scale alternative for next-generation light sources and lepton colliders. The maximum energy gain in a single-stage LWFA is limited by dephasing, which occurs when the trapped particles outrun the accelerating phase of the wakefield. Here, we demonstrate that a single space–time structured laser pulse can be used for ionization injection and electron acceleration over many dephasing lengths in the bubble regime. Simulations of a dephasingless laser wakefield accelerator driven by a 6.2-J laser pulse show 25 pC of injected charge accelerated over 20 dephasing lengths (1.3 cm) to a maximum energy of 2.1 GeV. The space–time structured laser pulse features an ultrashort, programmable-trajectory focus. Accelerating the focus, reducing the focused spot-size variation, and mitigating unwanted self-focusing stabilize the electron acceleration, which improves beam quality and leads to projected energy gains of 125 GeV in a single, sub-meter stage driven by a 500-J pulse.

43 PARTICLE ACCELERATORS↗
DOE OSTI2022

Accelerated steady-state electrostatic particle-in-cell simulation of Langmuir probes

First-principles particle-in-cell (PIC) simulation is a powerful tool for understanding plasma behavior, but this power often comes at great computational expense. Artificially reducing the ion/electron mass ratio is a time-honored practice to reduce simulation costs. Usually, this is a severe approximation. However, for steady-state collisionless, electrostatic (Vlasov–Poisson) systems, the solution with reduced mass ratio can be scaled to the solution for the real mass ratio, with no approximation. This “scaled mass” method, which works with already-existing PIC codes, can reduce the computation time for a large class of electrostatic PIC simulations by the square root of the mass ratio. The particle distributions of the resulting steady state must be trivially rescaled to yield the true distributions, but the self-consistent electrostatic field is independent of the mass ratio. This method is equivalent to “numerical timestepping,” an approach that evolves electron and ion populations with different time steps. Numerical timestepping can be viewed as a special case of the speed-limited PIC (SLPIC) method, which is not restricted to steady-state phenomena. Although the scaled-mass approach is simplest, numerical timestepping and SLPIC more easily generalize to include other effects, such as collisions. The equivalence of these new approaches is demonstrated by applying them to simulate a cylindrical Langmuir probe in electron–argon plasma, speeding up simulation by two orders of magnitude. Methods such as SLPIC can therefore play an invaluable role in interpreting probe measurements by including geometric effects, collisions, secondary emission, and non-Maxwellian distributions.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
DOE OSTI2024

Zero-RK Acceleration of Low-Life-cycle Carbon Fuel (LLFC)Simulations

Designing modern combustion systems now relies on computer models that predict how changes in design will affect performance. These models have replaced older methods that relied on the designer’s intuition or costly and time-consuming physical testing. By using improved models, design cycles can be shortened and cleaner and more efficient combustion devices can be created. This project aims to improve computer simulations of low-life-cycle carbon fuels (LLCFs) with the goal of making these simulations faster and more accurate for predicting combustion in vehicles.

02 PETROLEUM↗
DOE OSTI2021

Ion Acceleration and the Development of a Power-law Energy Spectrum in Magnetic Reconnection

How charged particles are accelerated efficiently and form a power-law energy spectrum in magnetic reconnection is a problem that is not well understood. In a previous paper, it was shown that the electron Kelvin–Helmholtz instability (EKHI) in force-free magnetic reconnection generates fast-expanding vortices that can accelerate electrons in a few tens of ion gyroperiods (less than 1 ms in the solar corona) to form a power-law energy distribution. In this paper, we present a particle-in-cell (PIC) simulation study of ion acceleration in force-free magnetic reconnection in the presence of the EKHI-induced turbulence. We find that ions are not significantly accelerated by the EKHI-induced stochastic electric field until the magnetic vortices expand to sizes comparable to the ion gyroradius. The Alfvén waves generated by the EKHI couple with the magnetic vortices, leading to resonance between the ions inside the magnetic vortices and Alfvén waves and enhanced ion heating. The induced Alfvén wave resonance results in a broken power-law energy spectrum with a breakpoint at $\sim {m}_{i}{v}_{A}^{2}$, where v A is the Alfvén velocity. Here, we show that the process that forms the nonthermal tail is a second-order Fermi mechanism and the mean spectral index is α = (1 + 4 a 2 D/R) /2, where D is the spatial scale of the inductive electric field, R is that of vortices, and a = B g /B 0 , with ratio of guide field B g and asymptotic B 0 .

79 ASTRONOMY AND ASTROPHYSICS↗
NASA NTRS1991

Navier-Stokes simulation of the supersonic combustion flowfield in a ram accelerator

A computational study of the ram accelerator, a ramjet-in-tube device for accelerating projectiles to ultrahigh velocities, is presented. The analysis is performed using a fully implicit TVD scheme that efficiently solves the Reynolds-averaged Navier-Stokes equations and the species continuity equations associated with a finite rate combustion model. Previous analyses of this concept were based on inviscid assumptions. The present results indicate that viscous effects are of primary importance; in all the cases studied, shock-induced combustion always started in the boundary layer. The effects of Mach number, mixture composition, pressure, and turbulence are investigated for various configurations. Two types of combustion processes, one stable and the other unstable, were observed depending on the inflow conditions. In the unstable case, a detonation wave is formed, which propagates upstream and unstarts the ram accelerator. In the stable case, a solution that converges to steady-state is obtained, in which the combustion wave remains stationary with respect to the ram accelerator projectile. The possibility of stabilizing the detonation wave by means of a backward facing step is also investigated. In addition to these studies, two numerical techniques were tested. These two techniques are vector extrapolation to accelerate convergence, and a diagonal formulation that eliminates the expense of inverting large block matrices that arise in chemically reacting flows.

Yungster, Shaye↗
NASA NTRS1991

Navier-Stokes simulation of the supersonic combustion flowfield in a ram accelerator

A computational study of the ram accelerator, a ramjet-in-tube device for accelerating projectiles to ultrahigh velocities, is presented. The analysis is performed using a fully implicit TVD scheme that efficiently solves the Reynolds-averaged Navier-Stokes equations and the species continuity equations associated with a finite rate combustion model. The present results indicate that viscous effects are of primary importance in all the cases studied, shock-induced combustion always started in the boundary layer. The effects of Mach number, mixture composition, pressure and tubulence are investigated for various configurations. Two types of combustion processes, one stable and the other unstable, were observed depending on the inflow conditions. The possibility of stabilizing the detonation wave by means of a backward facing step is also investigated. Two numerical techniques were tested: vector extrapolation, to accelerate convergence, and a diagonal formulation that eliminates the expense of inverting large block matrices which arise in chemically reacting flows.

Yungster, Shaye↗
NASA NTRS2017

A First-Principles Model Based on Saturation of the Electron Cyclotron Drift Instability for Electron Transport in Hydrodynamics Simulations of Hall Thruster Plasmas

We present a computational model based on the hypothesis that the higher-than-expected electron mobility across magnetic field lines observed in Hall thrusters is due to the growth and eventual saturation of the electron cyclotron drift instability. The key improvement of this model with respect to previous work is that it decouples the saturation of the instability from the correlation that exists between mobility and magnitude of the wave perturbations in linear theory, thereby enabling first-principles simulations. The model has been incorporated in the 2-D (r-z) multi-fluids code Hall2De and simulations of the H6 thruster at 300 V, 20 A are numerically stable and achieve a steady-state solution at a computational cost that is not significantly higher than previous Hall2De simulations. The computed location of the acceleration region is found to be within 10% of the length of the acceleration channel compared to that inferred by experiments. The simulations also capture well the plasma gradients along the channel centerline of this thruster. To further establish the validity of this model, we plan to conduct simulations of other thrusters and/or operating conditions.

Lopez Ortega, Alejandro↗
DOE OSTI2015

Simulation of Cascaded Longitudinal-Space-Charge Amplifier at the Fermilab Accelerator Science & Technology (Fast) Facility

Cascaded Longitudinal Space Charge Amplifiers (LSCA) have been proposed as a mechanism to generate density modulation over a board spectral range. The scheme has been recently demonstrated in the optical regime and has confirmed the production of broadband optical radiation. In this paper we investigate, via numerical simulations, the performance of a cascaded LSCA beamline at the Fermilab Accelerator Science & Technology (FAST) facility to produce broadband ultraviolet radiation. Our studies are carried out using elegant with included tree-based grid-less space charge algorithm.

43 PARTICLE ACCELERATORS↗