相关论文: The AFLOW Library of Crystallographic Prototypes: …

Large databases such as aflowlib.org provide valuable data sources for discovering material trends through machine learning. Although a REST API and query language are available, there is a learning curve associated with the AFLUX language…

The Astrophysics Source Code Library, started in 1999, has in the past three years grown from a repository for 40 codes to a registry of over 700 codes that are now indexed by ADS. What comes next? We examine the future of the ASCL, the…

We introduce CAFLOW, a new diverse image-to-image translation model that simultaneously leverages the power of auto-regressive modeling and the modeling efficiency of conditional normalizing flows. We transform the conditioning image into a…

Large language models (LLMs) have demonstrated remarkable potential in solving complex tasks across diverse domains, typically by employing agentic workflows that follow detailed instructions and operational sequences. However, constructing…

To enable materials databases supporting computational and experimental research, it is critical to develop platforms that both facilitate access to the data and provide the tools used to generate/analyze it - all while considering the…

We present a proof-of-concept system that automates iconographic classification and content-based recommendation of digitized artworks using the Iconclass vocabulary and selected artificial intelligence methods. The prototype implements a…

Tight-binding models provide a conceptually transparent and computationally efficient method to represent the electronic properties of materials. With AFLOW$\pi$ we introduce a framework for high-throughput first principles calculations…

Recent advancements in AI foundation models have made it possible for them to be utilized off-the-shelf for creative tasks, including ideating design concepts or generating visual prototypes. However, integrating these models into the…

We introduce MLFMF, a collection of data sets for benchmarking recommendation systems used to support formalization of mathematics with proof assistants. These systems help humans identify which previous entries (theorems, constructions,…

We introduce the Unified Cluster Catalogue, the largest catalogue of stellar clusters currently listing nearly 14000 objects. In this initial release it exclusively contains Milky Way open clusters, with plans to include other objects in…

The Astrophysics Source Code Library (ASCL) contains 3000 metadata records about astrophysics research software and serves primarily as a registry of software, though it also can and does accept code deposit. Though the ASCL was started in…

Many proof assistant libraries contain formalizations of the same mathematical concepts. The concepts are often introduced (defined) in different ways, but the properties that they have, and are in turn formalized, are the same. For the…

Inspired by the success of Large Language Models (LLMs), the development of Large Atom Models (LAMs) has gained significant momentum in scientific computation. Since 2022, the Deep Potential team has been actively pretraining LAMs and…

The realization of novel technological opportunities given by computational and autonomous materials design requires efficient and effective frameworks. For more than two decades, aflow++ (Automatic-Flow Framework for Materials Discovery)…

The Astrophysics Source Code Library (ASCL) is a free online registry for source codes of interest to astronomers, astrophysicists, and planetary scientists. It lists, and in some cases houses, software that has been used in research…

The expansion of programmatically-accessible materials data has cultivated opportunities for data-driven approaches. Highly-automated frameworks like AFLOW not only manage the generation, storage, and dissemination of materials data, but…

The Astrophysics Source Code Library (ASCL), founded in 1999, is a free on-line registry for source codes of interest to astronomers and astrophysicists. The library is housed on the discussion forum for Astronomy Picture of the Day (APOD)…

Foundation models have demonstrated a great ability to achieve general human-level intelligence far beyond traditional approaches. As the technique keeps attracting attention from the AI community, an increasing number of foundation models…

The LOFAR radio telescope creates Petabytes of data per year. This data is important for many scientific projects. The data needs to be efficiently processed within the timespan of these projects in order to maximize the scientific impact.…

Quantum electrodynamics and electroweak corrections are important ingredients for many theoretical predictions at the LHC. This paper documents APFEL, a new PDF evolution package that allows for the first time to perform DGLAP evolution up…