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The nuclear industry possesses a wealth of valuable information locked away in unstructured text data. This data, however, is not readily usable for advanced Large Language Model (LLM) applications that require clean, structured…

Computation and Language · Computer Science 2025-06-11 Muhammad Anwar , Daniel Lau , Mishca de Costa , Issam Hammad

The Workshop on Nuclear Data Needs and Capabilities for Applications (NDNCA) was held at Lawrence Berkeley National Laboratory (LBNL) on 27-29 May 2015. The goals of NDNCA were compile nuclear data needs across a wide spectrum of applied…

This review presents some of the challenges in constructing models of atomic nuclei starting from theoretical descriptions of the strong interaction between nucleons. The focus is on statistical computing and methods for analyzing the link…

Nuclear Theory · Physics 2019-12-06 Andreas Ekström

We describe OpenFCI, an open source implementation of the full configuration-interaction method (FCI) for two-dimensional quantum dots with optional use of effective renormalized interactions. The code is written in C++ and is available…

Mesoscale and Nanoscale Physics · Physics 2008-10-16 Simen Kvaal

We introduce atomicrex, an open-source code for constructing interatomic potentials as well as more general types of atomic-scale models. Such effective models are required to simulate extended materials structures comprising many thousands…

Materials Science · Physics 2020-08-03 Alexander Stukowski , Erik Fransson , Markus Mock , Paul Erhart

Quantum computing, an innovative computing system carrying prominent processing rate, is meant to be the solutions to problems in many fields. Among these realms, the most intuitive application is to help chemical researchers correctly…

Quantum Physics · Physics 2022-12-29 Qingchun Wang , Huan-Yu Liu , Qing-Song Li , Jianyu Zhao , Qiankun Gong , Ye Li , Yu-Chun Wu , Guo-Ping Guo

NLTK, the Natural Language Toolkit, is a suite of open source program modules, tutorials and problem sets, providing ready-to-use computational linguistics courseware. NLTK covers symbolic and statistical natural language processing, and is…

Computation and Language · Computer Science 2007-05-23 Edward Loper , Steven Bird

The Combustion Toolbox (CT) is a newly developed open-source thermochemical code designed to solve problems involving chemical equilibrium for both gas- and condensed-phase species. The kernel of the code is based on the theoretical…

Chemical Physics · Physics 2026-01-06 Alberto Cuadra , César Huete , Marcos Vera

We present an open source Python library for simulating overlapping (i.e., blended) images of galaxies and performing self-consistent comparisons of detection and deblending algorithms based on a suite of metrics. The package, named…

In recent years, several successful applications of the Artificial Neural Networks (ANNs) have emerged in nuclear physics and high-energy physics, as well as in biology, chemistry, meteorology, and other fields of science. A major goal of…

Retrieving operational data from nuclear power plants requires exceptional accuracy and transparency due to the criticality of the decisions it supports. Traditionally, natural language to SQL (NL-to-SQL) approaches have been explored for…

Computation and Language · Computer Science 2025-06-11 Mishca de Costa , Muhammad Anwar , Dave Mercier , Mark Randall , Issam Hammad

Computer vision techniques have immense potential for materials design applications. In this work, we introduce an integrated and general-purpose AtomVision library that can be used to generate, curate scanning tunneling microscopy (STM)…

Materials Science · Physics 2023-03-06 Kamal Choudhary , Ramya Gurunathan , Brian DeCost , Adam Biacchi

Nucleus is a typical many-body quantum system. Full calculation of a nuclear system in a classical computer is far beyond the capacity of current classical computers. With fast development of hardware, the prospect of using quantum…

Quantum Physics · Physics 2022-05-25 Peng Lv , Shi-Jie Wei , Hao-Nan Xie , Gui-Lu Long

Coupled-cluster theory is a powerful tool for first-principles calculations of atomic nuclei, enabling accurate predictions of nuclear observables across the Segr\`e chart. While coupled-cluster computations are especially efficient at…

Nuclear Theory · Physics 2026-04-08 F. Marino , F. Bonaiti , P. Demol , S. Bacca , T. Duguet , G. Hagen , G. R. Jansen , T. Papenbrock , A. Tichai

TREXIO is an open-source file format and library developed for the storage and manipulation of data produced by quantum chemistry calculations. It is designed with the goal of providing a reliable and efficient method of storing and…

The modeling of physical processes is an integral part of scientific and technical research. In this area, the Extendible C++ Application in Quantum Technologies (ECAQT) package provides the numerical simulations and modeling of complex…

Computational Physics · Physics 2013-01-10 H. V. Astsatryan , T. V. Gevorgyan , A. R. Shahinyan

The goal of nuclear structure theory is to build a comprehensive microscopic framework in which properties of nuclei and extended nuclear matter, and nuclear reactions and decays can all be consistently described. Due to novel theoretical…

Nuclear Theory · Physics 2016-03-10 Witold Nazarewicz

We introduce NetKet, a comprehensive open source framework for the study of many-body quantum systems using machine learning techniques. The framework is built around a general and flexible implementation of neural-network quantum states,…

Quantum computers offer promising approaches to various fields. To use current noisy quantum computers, developers need to examine the compilation of a logical circuit, the status of available hardware, and noises in results. As those tasks…

Human-Computer Interaction · Computer Science 2024-09-26 Hyeok Kim , Kaitlin N. Smith

This paper provides the description of a novel, multi-purpose spline library. In accordance with the increasingly diverse modes of usage of splines, it is multi-purpose in the sense that it supports geometry representation, finite element…

Mathematical Software · Computer Science 2020-02-28 Markus Frings , Norbert Hosters , Corinna Müller , Max Spahn , Christoph Susen , Konstantin Key , Stefanie Elgeti