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Kinetic study by thermal decomposition of antiretroviral drugs, Efavirenz (EFV) and Lamivudine (3TC), usually present in the HIV cocktail, can be done by individual adjustment of the solid decomposition models. However, in some cases…

Based on deep neural networks (DNNs), deep learning has been successfully applied to many problems, but its mechanism is still not well understood -- especially the reason why over-parametrized DNNs can generalize. A recent statistical…

无序系统与神经网络 · 物理学 2025-06-10 Gang Huang , Lai Shun Chan , Hajime Yoshino , Ge Zhang , Yuliang Jin

Ultrasound elastography estimates the mechanical properties of the tissue from two Radio-Frequency (RF) frames collected before and after tissue deformation due to an external or internal force. This work focuses on strain imaging in…

图像与视频处理 · 电气工程与系统科学 2019-11-14 Abdelrahman Zayed , Hassan Rivaz

We present a novel method for temporal coherent reconstruction and tracking of clothed humans. Given a monocular RGB-D sequence, we learn a person-specific body model which is based on a dynamic surface function network. To this end, we…

计算机视觉与模式识别 · 计算机科学 2021-08-16 Andrei Burov , Matthias Nießner , Justus Thies

This paper presents a method to simulate the thermal behavior of 3D systems using a graph neural network. The method discussed achieves a significant speed-up with respect to a traditional finite-element simulation. The graph neural network…

计算工程、金融与科学 · 计算机科学 2022-09-29 Helios Sanchis-Alepuz , Monika Stipsitz

In this work, deep neural networks made up of multiple hidden Long Short-Term Memory (LSTM) and Feedforward layers are trained to predict the thermal behavior of the joint motors of robot manipulators. A model-free and scalable approach is…

机器人学 · 计算机科学 2025-09-17 Trung Kien La , Eric Guiffo Kaigom

Many important physical processes have dynamics that are too complex to completely model analytically. Optimisation of such processes often relies on intuition, trial-and-error, or the construction of empirical models. Machine learning…

The output of molecular dynamics simulations is high-dimensional, and the degrees of freedom among the atoms are related in intricate ways. Therefore, a variety of analysis frameworks have been introduced in order to distill complex motions…

生物大分子 · 定量生物学 2019-08-06 Brooke E. Husic , Frank Noé

In energy intensive industrial systems, an evaporative cooling process may introduce operational flexibility. Such flexibility refers to a systems ability to deviate from its scheduled energy consumption. Identifying the flexibility, and…

系统与控制 · 电气工程与系统科学 2022-05-20 Manu Lahariya , Farzaneh Karami , Chris Develder , Guillaume Crevecoeur

Foams are versatile by nature and ubiquitous in a wide range of applications, including padding, insulation, and acoustic dampening. Previous work established that foams 3D printed via Viscous Thread Printing (VTP) can in principle combine…

The imminent impact of immersive technologies in society urges for active research in real-time and interactive physics simulation for virtual worlds to be realistic. In this context, realistic means to be compliant to the laws of physics.…

图形学 · 计算机科学 2023-02-10 Quercus Hernández , Alberto Badías , Francisco Chinesta , Elías Cueto

The predictive accuracy of density functional theory (DFT) for alloy formation enthalpies is often limited by intrinsic energy resolution errors, particularly in ternary phase stability calculations. In this work, we present a machine…

材料科学 · 物理学 2025-03-10 Sergei I. Simak , Erna K. Delczeg-Czirjak , Olle Eriksson

In the present work, a machine learning based constitutive model for electro-mechanically coupled material behavior at finite deformations is proposed. Using different sets of invariants as inputs, an internal energy density is formulated…

计算工程、金融与科学 · 计算机科学 2022-08-30 Dominik K. Klein , Rogelio Ortigosa , Jesús Martínez-Frutos , Oliver Weeger

Classically, the constitutive behavior of materials is described either phenomenologically, or by homogenization approaches. Phenomenological approaches are computationally very efficient, but are limited for complex non-linear and…

计算物理 · 物理学 2020-01-28 Christoph Settgast , Geralf Hütter , Meinhard Kuna , Martin Abendroth

We present a new deep learning-based machine learning potential (MLP) for molecular dynamics simulations of solid carbon monoxide (CO), capable of accurately describing CO vibrations both in the fundamental state and in highly excited…

The mechanical behavior of closed-cell foams in compression is analyzed by means of the finite element simulation of a representative volume element of the microstructure. The digital model of the foam includes the most relevant details of…

材料科学 · 物理学 2020-01-08 M. Marvi-Mashhadi , C. S. Lopes , J. LLorca

Coarse-grained modeling in molecular simulations serves not only to extend accessible time and length scales beyond atomistic limits, but also to reduce high-dimensional chemical data to low-dimensional representations that expose the…

化学物理 · 物理学 2026-05-19 Michael N. Sakano , Alejandro Strachan

Elastic network models (ENM) and constraint-based, topological rigidity analysis are two distinct, coarse-grained approaches to study conformational flexibility of macromolecules. In the two decades since their introduction, both have…

生物大分子 · 定量生物学 2018-02-27 Dominik Budday , Sigrid Leyendecker , Henry van den Bedem

Non-rigid point cloud registration is a key component in many computer vision and computer graphics applications. The high complexity of the unknown non-rigid motion make this task a challenging problem. In this paper, we break down this…

计算机视觉与模式识别 · 计算机科学 2022-10-06 Yang Li , Tatsuya Harada

We propose a novel approach for deformation-aware neural networks that learn the weighting and synthesis of dense volumetric deformation fields. Our method specifically targets the space-time representation of physical surfaces from liquid…

图形学 · 计算机科学 2019-02-21 Lukas Prantl , Boris Bonev , Nils Thuerey
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