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Mechanical metamaterials utilize geometry to achieve exceptional mechanical properties, including those not typically possible for traditional materials. To achieve these properties, it is necessary to identify the proper structures and…

Applied Physics · Physics 2024-10-11 Jiakun Liu , Adam Taylor , Sage Fulco , Sumukh S. Pande , Kevin T. Turner

Modeling non-empirical and highly flexible interatomic potential energy surfaces (PES) using machine learning (ML) approaches is becoming popular in molecular and materials research. Training an ML-PES is typically performed in two stages:…

Materials Science · Physics 2021-01-05 Suresh Kondati Natarajan , Miguel A. Caro

Successful materials innovations can transform society. However, materials research often involves long timelines and low success probabilities, dissuading investors who have expectations of shorter times from bench to business. A…

Outdoor positioning systems based on the Global Navigation Satellite System have several shortcomings that have deemed their use for indoor positioning impractical. Location fingerprinting, which utilizes machine learning, has emerged as a…

Machine Learning · Computer Science 2022-05-31 Fahad Alhomayani , Mohammad H. Mahoor

This paper explores the use of optimization to design multifunctional metamaterials, and proposes a methodology for constructing a design envelope of potential properties. A thermal-mechanical metamaterial, proposed by Ai and Gao (2017), is…

Computational Engineering, Finance, and Science · Computer Science 2020-04-29 Ewan Fong , Sadik L. Omairey , Peter D. Dunning

Audio fingerprinting systems must efficiently and robustly identify query snippets in an extensive database. To this end, state-of-the-art systems use deep learning to generate compact audio fingerprints. These systems deploy indexing…

Audio and Speech Processing · Electrical Eng. & Systems 2023-01-20 Anup Singh , Kris Demuynck , Vipul Arora

In this paper a phase-field approach for structural topology optimization for a 3D-printing process which includes stress constraint and potentially multiple materials or multiscales is analyzed. First order necessary optimality conditions…

Optimization and Control · Mathematics 2019-07-16 Ferdinando Auricchio , Elena Bonetti , Massimo Carraturo , Dietmar Hömberg , Alessandro Reali , Elisabetta Rocca

Machine learning interatomic potentials have revolutionized complex materials design by enabling rapid exploration of material configurational spaces via crystal structure prediction with ab initio accuracy. However, critical challenges…

Processing-in-memory (PIM) is a promising computing paradigm to tackle the "memory wall" challenge. However, PIM system-level benefits over traditional von Neumann architecture can be reduced when the memory array cannot fully store all the…

Hardware Architecture · Computer Science 2025-03-03 Peilin Chen , Xiaoxuan Yang

In practice, objective functions of real-time control systems can have multiple local minimums or can dramatically change over the function space, making them hard to optimize. To efficiently optimize such systems, in this paper, we develop…

Optimization and Control · Mathematics 2022-01-26 Haowei Wang , Songhao Wang , Qun Meng , Szu Hui Ng

The accurate representation of variable renewable generation (RES, e.g., wind, solar PV) assets in capacity expansion planning (CEP) studies is paramount to capture spatial and temporal correlations that may exist between sites and impact…

Systems and Control · Electrical Eng. & Systems 2021-04-14 David Radu , Antoine Dubois , Mathias Berger , Damien Ernst

The growing need for creating surfaces with specific wetting properties, such as superhyrdophobic behavior, asks for novel methods for their efficient design. In this work, a fast computational method for the evaluation of patterned…

Applied Physics · Physics 2019-01-31 V. Krokos , G. Pashos , A. N. Spyropoulos , G. Kokkoris , A. G. Papathanasiou , A. G. Boudouvis

Placement is crucial in the physical design, as it greatly affects power, performance, and area metrics. Recent advancements in analytical methods, such as DREAMPlace, have demonstrated impressive performance in global placement. However,…

Machine Learning · Computer Science 2024-02-29 Ke Xue , Xi Lin , Yunqi Shi , Shixiong Kai , Siyuan Xu , Chao Qian

An overall objective of energy efficiency in the built environment is to improve building and systems performances in terms of durability, comfort and economics. In order to predict, improve and meet a certain set of performance…

Computational Engineering, Finance, and Science · Computer Science 2016-06-07 A. W. M. van Schijndel

Recent developments in the field of computational modeling of fracture have opened up possibilities for designing structures against failure. A special case, called interfacial fracture or delamination, can occur in loaded composite…

Optimization and Control · Mathematics 2022-09-13 Sukhminder Singh , Lukas Pflug , Julia Mergheim , Michael Stingl

Structure-informed materials informatics is a rapidly evolving discipline of materials science relying on the featurization of atomic structures or configurations to construct vector, voxel, graph, graphlet, and other representations useful…

Materials Science · Physics 2024-12-17 Adam M. Krajewski , Jonathan W. Siegel , Zi-Kui Liu

The study identifies a clear evolution from traditional methods to more advanced machine learning approaches. Current algorithms face persistent challenges, including degraded image quality, damaged ridge structures, and background noise,…

Computer Vision and Pattern Recognition · Computer Science 2025-08-20 Amit Kumar Trivedi , Jasvinder Pal Singh

In the last few decades, several novel algorithms have been designed for finding critical points on PES and the minimum energy paths connecting them. This has led to considerably improve our understanding of reaction mechanisms and kinetics…

Computational Engineering, Finance, and Science · Computer Science 2024-10-30 Sandra Liz Simon , Nitin Kaistha , Vishal Agarwal

Wide variety of engineering design tasks can be formulated as constrained optimization problems where the shape and topology of the domain are optimized to reduce costs while satisfying certain constraints. Several mathematical approaches…

Optimization and Control · Mathematics 2015-03-10 Igor Ostanin , Denis Zorin , Ivan Oseledets

Sampling complex free energy surfaces is one of the main challenges of modern atomistic simulation methods. The presence of kinetic bottlenecks in such surfaces often renders a direct approach useless. A popular strategy is to identify a…

Computational Physics · Physics 2019-09-25 Luigi Bonati , Yue-Yu Zhang , Michele Parrinello