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Diffusion models, which iteratively denoise data samples to synthesize high-quality outputs, have achieved empirical success across domains. However, optimizing these models for downstream tasks often involves nested bilevel structures,…

机器学习 · 计算机科学 2025-08-06 Quan Xiao , Hui Yuan , A F M Saif , Gaowen Liu , Ramana Kompella , Mengdi Wang , Tianyi Chen

Phase estimation protocols provide a fundamental benchmark for the field of quantum metrology. The latter represents one of the most relevant applications of quantum theory, potentially enabling the capability of measuring unknown physical…

We present a novel, generalised formulation to treat coupled structural integrity problems by combining phase field and multi-physics modelling. The approach exploits the versatility of the heat transfer equation and is therefore well…

计算工程、金融与科学 · 计算机科学 2025-06-27 Y. Navidtehrani , C. Betegón , E. Martínez-Pañeda

Robust discrete optimization is a highly active field of research where a plenitude of combinations between decision criteria, uncertainty sets and underlying nominal problems are considered. Usually, a robust problem becomes harder to…

最优化与控制 · 数学 2022-01-14 Marc Goerigk , Mohammad Khosravi

Phase measurement constitutes a key task in many fields of science, both in the classical and quantum regime. The higher precision of such measurement offers significant advances, and can also be utilised to achieve finer estimates for…

The CALPHAD system of fundamental phase-level databases, now known as the Materials Genome, has enabled a mature technology of computational materials design and qualification that has already met the acceleration goals of the national…

材料科学 · 物理学 2023-08-03 G. B Olson , Z. K. Liu

Large Language Models (LLM) are increasingly used for software development, yet existing benchmarks for LLM-based coding assistance do not reflect the constraints of High Energy Physics (HEP) and High Performance Computing (HPC) software.…

Modern computational neuroscience strives to develop complex network models to explain dynamics and function of brains in health and disease. This process goes hand in hand with advancements in the theory of neuronal networks and increasing…

Recent advances in probabilistic modelling have led to a large number of simulation-based inference algorithms which do not require numerical evaluation of likelihoods. However, a public benchmark with appropriate performance metrics for…

Understanding the microstuctural evolution during the sintering process is of high relevance as it is a key part in many industrial manufacturing processes. Simulations are one avenue to achieve this understanding, especially field-resolved…

材料科学 · 物理学 2023-05-17 Marco Seiz , Henrik Hierl , Britta Nestler

Quantum computers have the potential to provide an advantage over classical computers in a number of areas. Numerous metrics to benchmark the performance of quantum computers, ranging from their individual hardware components to entire…

We present a detailed benchmark comparing two state-of-the-art phase-field implementations for simulating alloy solidification under experimentally relevant conditions. The study investigates the directional solidification of Al-3wt%Cu…

材料科学 · 物理学 2026-04-30 Jiefu Tian , David Montiel , Kaihua Ji , Trevor Lyons , Jason Landini , Katsuyo Thornton , Alain Karma

Soft errors in memories and logic circuits are known to disturb program execution. In this context, the research community has been proposing a plethora of fault-tolerance (FT) solutions over the last decades, as well as fault-injection…

软件工程 · 计算机科学 2024-04-01 Tianhao Wang , Robin Thunig , Horst Schirmeier

Phase-field-based models have become common in material science, mechanics, physics, biology, chemistry, and engineering for the simulation of microstructure evolution. Yet, they suffer from the drawback of being computationally very costly…

We consider numerical solution of elliptic problems with heterogeneous diffusion coefficients containing thin highly conductive structures. Such problems arise e.g. in fractured porous media, reinforced materials, and electric circuits. The…

数值分析 · 数学 2020-07-22 Fredrik Hellman , Axel Målqvist , Siyang Wang

With recent advances in structural biology, including experimental techniques and deep learning-enabled high-precision structure predictions, molecular dynamics methods that scale up to large biomolecular systems are required. Current…

生物物理 · 物理学 2022-06-24 Tim Hempel , Simon Olsson , Frank Noé

In this paper a hyperbolic system of partial differential equations for two-phase mixture flows with $N$ components is studied. It is derived from a more complicated model involving diffusion and exchange terms. Important features of the…

偏微分方程分析 · 数学 2022-08-24 Maren Hantke , Christoph Matern , Gerald Warnecke , Hazem Yaghi

A benchmark of 25 nonlinear optimization problems with domain-induced discontinuity is proposed to support the performance evaluation of global optimization algorithms under feasibility-scarce and structurally discontinuous landscapes.…

最优化与控制 · 数学 2026-04-23 Peicong Cheng , Makoto Yamashita

Computational models of acoustic wave propagation are frequently used in transcranial ultrasound therapy, for example, to calculate the intracranial pressure field or to calculate phase delays to correct for skull distortions. To allow…

For the past six years, researchers in genetic programming and other program synthesis disciplines have used the General Program Synthesis Benchmark Suite to benchmark many aspects of automatic program synthesis systems. These problems have…

软件工程 · 计算机科学 2021-06-14 Thomas Helmuth , Peter Kelly