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Neural network potentials (NNPs) combine the computational efficiency of classical interatomic potentials with the high accuracy and flexibility of the ab initio methods used to create the training set, but can also result in unphysical…

Materials Science · Physics 2022-01-24 Leonid Kahle , Federico Zipoli

Deep neural networks have outperformed existing machine learning models in various molecular applications. In practical applications, it is still difficult to make confident decisions because of the uncertainty in predictions arisen from…

Machine Learning · Computer Science 2019-03-21 Seongok Ryu , Yongchan Kwon , Woo Youn Kim

This work is focused on the morphological classification of galaxies following the Hubble sequence in which the different classes are arranged in a hierarchy. The proposed method, BCNN, is composed of two main modules. First, a…

Instrumentation and Methods for Astrophysics · Physics 2024-09-04 Jonathan Serrano-Pérez , Raquel Díaz Hernández , L. Enrique Sucar

Statistical tools of uncertainty quantification can be used to assess the information content of measured observables with respect to present-day theoretical models; to estimate model errors and thereby improve predictive capability; to…

Nuclear Theory · Physics 2015-03-26 J. D. McDonnell , N. Schunck , D. Higdon , J. Sarich , S. M. Wild , W. Nazarewicz

Recent advances in computing power and the potential to make more realistic assumptions due to increased flexibility have led to the increased prevalence of simulation models in economics. While models of this class, and particularly…

General Economics · Economics 2019-06-12 Donovan Platt

The kernel ridge regression (KRR) approach is extended to include the odd-even effects in nuclear mass predictions by remodulating the kernel function without introducing new weight parameters and inputs in the training network. By taking…

Nuclear Theory · Physics 2021-06-03 X. H. Wu , L. H. Guo , P. W. Zhao

Bayesian neural networks (BNNs) promise improved generalization under covariate shift by providing principled probabilistic representations of epistemic uncertainty. However, weight-based BNNs often struggle with high computational…

Machine Learning · Statistics 2022-06-13 Trung Trinh , Markus Heinonen , Luigi Acerbi , Samuel Kaski

It is fascinating to predict the mass and width of the ordinary and exotic mesons solely based on their quark content and quantum numbers. Such prediction goes beyond conventional methodologies traditionally employed in hadron physics for…

High Energy Physics - Phenomenology · Physics 2024-09-09 M. Malekhosseini , S. Rostami , A. R. Olamaei , R. Ostovar , K. Azizi

Weight-sharing quantization has emerged as a technique to reduce energy expenditure during inference in large neural networks by constraining their weights to a limited set of values. However, existing methods for weight-sharing…

Machine Learning · Computer Science 2023-10-05 Christopher Subia-Waud , Srinandan Dasmahapatra

Bayesian neural networks (BNNs) demonstrate promising success in improving the robustness and uncertainty quantification of modern deep learning. However, they generally struggle with underfitting at scale and parameter efficiency. On the…

Within the framework of the dinuclear system model, this study delves into the impact of various nuclear mass models on evaluating the fusion probability of superheavy nuclei. Nuclear mass models, as crucial inputs to the DNS model, exhibit…

Nuclear Theory · Physics 2024-02-26 Chang Geng , Peng-Hui Chen , Fei Niu , Zu-Xing Yang , Xiang-Hua Zeng , Zhao-Qing Feng

A Bayesian network is a widely used probabilistic graphical model with applications in knowledge discovery and prediction. Learning a Bayesian network (BN) from data can be cast as an optimization problem using the well-known…

Artificial Intelligence · Computer Science 2018-11-14 Zhenyu A. Liao , Charupriya Sharma , James Cussens , Peter van Beek

Accurate parking availability prediction is critical for intelligent transportation systems, but real-world deployments often face data sparsity, noise, and unpredictable changes. Addressing these challenges requires models that are not…

Machine Learning · Computer Science 2026-03-31 Alireza Nezhadettehad , Arkady Zaslavsky , Abdur Rakib , Seng W. Loke

Some properties of the modified Bethe-Weizsacker mass formula (BWM) are discussed. As BWM has no shell effect included, the extra-stability or, magicity in nuclei clearly stands out when experimental mass data are compared with BWM…

Nuclear Theory · Physics 2007-05-23 C. Samanta , S. Adhikari

Bayesian neural Networks (BNNs) are a promising method of obtaining statistical uncertainties for neural network predictions but with a higher computational overhead which can limit their practical usage. This work explores the use of high…

Machine Learning · Computer Science 2020-09-09 Himanshu Sharma , Elise Jennings

We present an algorithm based on artificial neural networks (ANNs), that estimates the mass ratio in a binary black hole collision out of given Gravitational Wave (GW) strains. In this analysis, the ANN is trained with a sample of GW…

Instrumentation and Methods for Astrophysics · Physics 2016-10-14 M. Carrillo , M. Gracia-Linares , J. A. González , F. S. Guzmán

Bayesian methods have been very successful in quantifying uncertainty in physics-based problems in parameter estimation and prediction. In these cases, physical measurements y are modeled as the best fit of a physics-based model…

Data Analysis, Statistics and Probability · Physics 2015-02-06 Dave Higdon , Jordan D. McDonnell , Nicolas Schunck , Jason Sarich , Stefan M. Wild

Deep neural networks (DNN) are versatile parametric models utilised successfully in a diverse number of tasks and domains. However, they have limitations---particularly from their lack of robustness and over-sensitivity to out of…

Machine Learning · Statistics 2020-01-01 John Mitros , Brian Mac Namee

In this work we investigate the reasons why Batch Normalization (BN) improves the generalization performance of deep networks. We argue that one major reason, distinguishing it from data-independent normalization methods, is randomness of…

Machine Learning · Computer Science 2018-11-05 Alexander Shekhovtsov , Boris Flach

Binarized neural networks, or BNNs, show great promise in edge-side applications with resource limited hardware, but raise the concerns of reduced accuracy. Motivated by the complex neural networks, in this paper we introduce complex…

Neural and Evolutionary Computing · Computer Science 2021-04-21 Yanfei Li , Tong Geng , Ang Li , Huimin Yu