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Simulations of high energy density physics are expensive, largely in part for the need to produce non-local thermodynamic equilibrium opacities. High-fidelity spectra may reveal new physics in the simulations not seen with low-fidelity…

等离子体物理 · 物理学 2023-02-08 Michael D. Vander Wal , Ryan G. McClarren , Kelli D. Humbird

Simulations of high energy density physics are expensive in terms of computational resources. In particular, the computation of opacities of plasmas in the non-local thermal equilibrium (NLTE) regime can consume as much as 90\% of the total…

等离子体物理 · 物理学 2021-10-12 Michael D. Vander Wal , Ryan G. McClarren , Kelli D. Humbird

Neural networks (NNs) are often used as surrogates or emulators of partial differential equations (PDEs) that describe the dynamics of complex systems. A virtually negligible computational cost of such surrogates renders them an attractive…

数值分析 · 数学 2021-05-04 Dong H. Song , Daniel M. Tartakovsky

Due to their high degree of expressiveness, neural networks have recently been used as surrogate models for mapping inputs of an engineering system to outputs of interest. Once trained, neural networks are computationally inexpensive to…

Lattice thermal conductivity (TC) of semiconductors is crucial for various applications, ranging from microelectronics to thermoelectrics. Data-driven approach can potentially establish the critical composition-property relationship needed…

材料科学 · 物理学 2022-08-30 Zeyu Liu , Meng Jiang , Tengfei Luo

Thomson scattering (TS) diagnostics provide reliable, minimally perturbative measurements of fundamental plasma parameters, such as electron density ($n_e$) and electron temperature ($T_e$). Deep neural networks can provide accurate…

When applying machine learning to sensitive data, one has to find a balance between accuracy, information security, and computational-complexity. Recent studies combined Homomorphic Encryption with neural networks to make inferences while…

机器学习 · 计算机科学 2019-06-07 Alon Brutzkus , Oren Elisha , Ran Gilad-Bachrach

We present a study of using machine learning to enhance hohlraum design for opacity measurement experiments. For opacity experiments we desire a hohlraum that, when its interior walls are illuminated by theNational Ignition Facility (NIF)…

仪器与探测器 · 物理学 2021-03-17 Ryan G. McClarren , I. L. Tregillis , Todd J. Urbatsch , E. S. Dodd

Training deep neural networks using simulations typically requires very large numbers of simulated events. This can be a large computational burden and a limitation in the performance of the deep learning algorithm when insufficient numbers…

高能物理 - 实验 · 物理学 2023-03-21 Andrew Chappell , Leigh H. Whitehead

A machine-learning non-contact method to determine the temperature of a laser gain medium via its laser emission with a trained few-layer neural net model is presented. The training of the feed-forward Neural Network (NN) enables the…

光学 · 物理学 2024-10-31 Jakob Mannstadt , Arash Rahimi-Iman

A persistent challenge in machine learning for electronic-structure calculations is the sharp imbalance between abundant low-fidelity data like DFT or TDDFT results and the scarcity of high-fidelity data like many-body perturbation theory…

化学物理 · 物理学 2025-12-15 Dario Baum , Arno Förster , Lucas Visscher

A concept of using Neural Ordinary Differential Equations(NODE) for Transfer Learning has been introduced. In this paper we use the EfficientNets to explore transfer learning on CIFAR-10 dataset. We use NODE for fine-tuning our model. Using…

机器学习 · 计算机科学 2020-01-22 Rajath S , Sumukh Aithal K , Natarajan Subramanyam

The integration of density functional theory (DFT) with machine learning enables efficient \textit{ab initio} electronic structure calculations for ultra-large systems. In this work, we develop a transfer learning framework tailored for…

材料科学 · 物理学 2025-01-23 Ting Bao , Ning Mao , Wenhui Duan , Yong Xu , Adrian Del Maestro , Yang Zhang

We develop new transfer learning algorithms to accelerate prediction of material properties from ab initio simulations based on density functional theory (DFT). Transfer learning has been successfully utilized for data-efficient modeling in…

计算物理 · 物理学 2020-07-01 Schuyler Krawczuk , Daniele Venturi

Inertial confinement fusion (ICF) experiments are designed using computer simulations that are approximations of reality, and therefore must be calibrated to accurately predict experimental observations. In this work, we propose a novel…

机器学习 · 计算机科学 2018-12-17 K. D. Humbird , J. L. Peterson , R. G. McClarren

The continuous improvement in weather forecast skill over the past several decades is largely due to the increasing quantity of available satellite observations and their assimilation into operational forecast systems. Assimilating these…

大气与海洋物理 · 物理学 2025-04-24 Lucas Howard , Aneesh C. Subramanian , Gregory Thompson , Benjamin Johnson , Thomas Auligne

Transfer learning (TL) is becoming a powerful tool in scientific applications of neural networks (NNs), such as weather/climate prediction and turbulence modeling. TL enables out-of-distribution generalization (e.g., extrapolation in…

流体动力学 · 物理学 2023-07-04 Adam Subel , Yifei Guan , Ashesh Chattopadhyay , Pedram Hassanzadeh

Neural network potentials (NNPs) offer a fast and accurate alternative to ab-initio methods for molecular dynamics (MD) simulations but are hindered by the high cost of training data from high-fidelity Quantum Mechanics (QM) methods. Our…

化学物理 · 物理学 2024-12-10 Stephan Thaler , Cristian Gabellini , Nikhil Shenoy , Prudencio Tossou

The reliability of atomistic simulations depends on the quality of the underlying energy models providing the source of physical information, for instance for the calculation of migration barriers in atomistic Kinetic Monte Carlo…

Data scarcity, bias, and experimental noise are all frequently encountered problems in the application of deep learning to chemical and material science disciplines. Transfer learning has proven effective in compensating for the lack in…

化学物理 · 物理学 2021-03-16 Florence H. Vermeire , William H. Green
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