By Professor Bram Hoex

Preprints

Lv T; Chen A; Xie F; Wu C; Meng J; Zhou D; Hoex B; Zhong Z; Xie T, 2025, AtomWorld: A Benchmark for Evaluating Spatial Reasoning in Large Language Models on Crystalline Materials

Yang Z; Wan Y; Yan S; Matsuda Y; Xie T; Hoex B; Song L, 2025, DrugMCTS: a drug repurposing framework combining multi-agent, RAG and Monte Carlo Tree Search, http://dx.doi.org/10.48550/arxiv.2507.07426

Baldacchino A; Brett M; Carwithen B; McNab S; Tong J; Zhang V; Chang N; Ciesla A; de Clercq D; Campomolla S; Collins M; Jiang J; Kavungathodi M; Mo A; Pearce P; Hoex B; McCamey D; Nielsen M; Beves J; Ekins-Daukes N; Schmidt T; Tayebjee M, 2025, Singlet Fission c-Si Solar Cells: Beyond Tetracene, http://dx.doi.org/10.26434/chemrxiv-2025-f5fh8

Zhang S; Yang S; Xie T; Xue X; Hu Z; Li R; Qu W; Yin Z; Fu T; Hu D; Bran AM; Ran N; Hoex B; Zuo W; Schwaller P; Ouyang W; Bai L; Zhang Y; Duan L; Tang S; Zhou D, 2025, Position: Intelligent Science Laboratory Requires the Integration of Cognitive and Embodied AI, http://dx.doi.org/10.48550/arxiv.2506.19613

Xie T; Wan Y; Liu Y; Zeng Y; Wang S; Zhang W; Grazian C; Kit C; Ouyang W; Zhou D; Hoex B, 2024, DARWIN 1.5: Large Language Models as Materials Science Adapted Learners, http://dx.doi.org/10.48550/arxiv.2412.11970

Xie T; Zhang H; Wang S; Wan Y; Razzak I; Kit C; Zhang W; Hoex B, 2024, ByteScience: Bridging Unstructured Scientific Literature and Structured Data with Auto Fine-tuned Large Language Model in Token Granularity, http://dx.doi.org/10.48550/arxiv.2411.12000

Wan Y; Xie T; Wu N; Zhang W; Kit C; Hoex B, 2024, From Tokens to Materials: Leveraging Language Models for Scientific Discovery, http://dx.doi.org/10.48550/arxiv.2410.16165

Wan Y; Liu Y; Ajith A; Grazian C; Hoex B; Zhang W; Kit C; Xie T; Foster I, 2024, SciQAG: A Framework for Auto-Generated Science Question Answering Dataset with Fine-grained Evaluation, http://dx.doi.org/10.48550/arxiv.2405.09939

Ye Y; Ren J; Wang S; Wan Y; Razzak I; Hoex B; Wang H; Xie T; Zhang W, 2024, Construction and Application of Materials Knowledge Graph in Multidisciplinary Materials Science via Large Language Model, http://dx.doi.org/10.48550/arxiv.2404.03080

Ye Y; Zhou Y; Wang Y; Hoex B; Zhu X; Chen D; Xue W; Wei T; Chen B; Cheng M; Lu J; Yin H; Ouyang Z, 2024, Damp-Heat Stability Investigation of Glass-Backsheet Modules Based on Topcon Solar Cells, http://dx.doi.org/10.2139/ssrn.4986461

Madumelu C; Bowen F; Genhua J; Bao J; Seunghwan S; Chen R; Hallam B; Hoex B; Wright M, 2024, Impact of Oxide Thickness, Emitter Sheet Resistance, and Polysilicon Doping Concentration on the Passivation Quality and Long-Term Stability of Topcon Solar Cells, http://dx.doi.org/10.2139/ssrn.4685631

Xie T; Wan Y; Huang W; Yin Z; Liu Y; Wang S; Linghu Q; Kit C; Grazian C; Zhang W; Razzak I; Hoex B, 2023, DARWIN Series: Domain Specific Large Language Models for Natural Science, http://dx.doi.org/10.48550/arxiv.2308.13565

Xie T; Wan Y; Huang W; Zhou Y; Liu Y; Linghu Q; Wang S; Kit C; Grazian C; Zhang W; Hoex B, 2023, Large Language Models as Master Key: Unlocking the Secrets of Materials Science with GPT, http://dx.doi.org/10.48550/arxiv.2304.02213

Xie T; Wan Y; Zhou Y; Huang W; Liu Y; Linghu Q; Wang S; Kit C; Grazian C; Zhang W; Hoex B, 2023, Large Language Models as Master Key: Unlocking the Secrets of Materials Science, http://dx.doi.org/10.2139/ssrn.4534137

Rougieux F; Sen C; Abbott M; Hoex B, 2023, Light-Activated Surface Passivation for More Efficient Silicon Heterojunction Solar Cells: Origin, Physics and Stability, http://dx.doi.org/10.2139/ssrn.4653481

Xie T; Wan Y; Li W; Linghu Q; Wang S; Cai Y; Liu H; Kit C; Grazian C; Hoex B, 2022, Interdisciplinary Discovery of Nanomaterials Based on Convolutional Neural Networks, http://dx.doi.org/10.48550/arxiv.2212.02805

Madumelu C; Cai Y; Hollemann C; Peibst R; Hoex B; Hallam B; Soeriyadi A, Assessing the Stability of P+ and N+ Polysilicon Passivating Contacts with Various Capping Layers on P-Type Wafers, http://dx.doi.org/10.2139/ssrn.4289694

Sen C; Wang H; Wu X; Khan MU; Chan C; Abbott M; Hoex B, Four Failure Modes in Silicon Heterojunction Glass-Backsheet Modules, http://dx.doi.org/10.2139/ssrn.4293027

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