density functional theory 1large language models 1machine learning 1materials discovery 1topological materials 1
From the 1 of 2 papers with an AI index.
2 papers
cond-mat.mtrl-sci2026
TXL Fusion: A Hybrid Machine Learning Framework Integrating Chemical Heuristics and Large Language Models for Topological Materials Discovery
Arif Ullah, Rajibul Islam, Yangming Huang +4
The paper presents TXL Fusion, a hybrid machine‑learning system that combines chemical heuristics, physics‑based descriptors, and large language model embeddings to classify and pr…
cond-mat.stat-mech2026
Gravity-Induced Modulation of Negative Differential Thermal Resistance in Fluids
Qiyuan Zhang, Juncheng Guo, Juchang Zou +1
We investigate how gravity influences negative differential thermal resistance (NDTR) in fluids modeled by multiparticle collision dynamics. In the integrable case, we derive the h…