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Paper Citation Record · LEDGER

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools

As of 8 August 2026, this Paper Citation Record lists 100 of 188 outbound references and 6 inbound Pith citation observations for arXiv:2506.20743.

A citation records a reference. It does not transfer a finding from one paper to another.

pith.paper-citation-record.v1
2506.20743 v1

Coverage vector

measured 100 of 188 reference resolution

Typed states for the displayed outbound observations.

Source: paper_references, paper_reference_links, observed 2026-08-06T22:45:57.493434Z

measured 106 of 106 standing notices

One-hop event checks from named stored sources.

Source: scholarly_work_events, retraction_status_cache, observed 2026-08-08T06:32:00.761636+00:00

measured 6 of 6 inbound itemization

Pith citing papers itemized under the disclosed page cap.

Source: paper_references, paper_reference_links, observed 2026-08-04T08:48:26.638924Z

measured 0 of 1 external citation measurements

A source-named dated measurement, never combined with another source.

Source: arxiv_reference, observed 2026-07-01T21:06:13.646446Z

Reference resolution

100 of 188 outbound references displayed

  • verified exact4
  • verified fuzzy0
  • unresolved96
  • parse uncertain0
  • malformed identifier0
  • metadata mismatch0

External citation measurements

No source-named external measurement is stored.

Outbound references

Observation de85b6d5-007e-4032-9732-33ca316ce060 · outbound

This paper cites Foundation models for materials discovery–current state and future directions.npj Computational Materials, 11(1):61, 2025.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools Foundation models for materials discovery–current state and future directions.npj Computational Materials, 11(1):61, 2025

Reference 1

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source=pdf_text observed=2026-08-06T22:45:49.042703Z digest=sha256:bfc2d8946f7e7edcfa50b2f5e878a451d36ff777ec9ee729692ea03c0c005be1

Observation d8b5ccd7-5672-4fdf-a036-8c1cfb9a21da · outbound

This paper cites Crystalline material discovery in the era of artificial intelligence.arXiv preprint arXiv:2408.08044, 2024.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools Crystalline material discovery in the era of artificial intelligence.arXiv preprint arXiv:2408.08044, 2024

Reference 2

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source=pdf_text observed=2026-08-06T22:45:49.102968Z digest=sha256:5b9714fcacff1ce5a47496d73ff0dd31001a9906b7e99ce2062b6b797e891e9f

Observation abd20430-5f03-42fd-89f6-b5ca9b7fc3f9 · outbound

This paper cites Ai-driven inverse design of materials: Past, present and future.Chinese Physics Letters, 2024.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools Ai-driven inverse design of materials: Past, present and future.Chinese Physics Letters, 2024

Reference 3

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source=pdf_text observed=2026-08-06T22:45:49.158973Z digest=sha256:5677db93954a1aaac196388514cb56b96a558644274bfc64c62dd455c47b6acf

Observation 81e95799-2177-451e-b04c-e5500609b328 · outbound

This paper cites A review of large language models and autonomous agents in chemistry.Chemical Science, 2025.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools A review of large language models and autonomous agents in chemistry.Chemical Science, 2025

Reference 4

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source=pdf_text observed=2026-08-06T22:45:49.220492Z digest=sha256:7d335660abd2626fe2096d6a88e72bd5521511dedd0648f3f2476001ab53b41c

Observation c9e68cec-296d-4efa-966c-39d6d9a51c0a · outbound

This paper cites A strategic approach to machine learning for material science: how to tackle real-world challenges and avoid pitfalls.Chemistry of Materials, 34(17): 7650–7665, 2022.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools A strategic approach to machine learning for material science: how to tackle real-world challenges and avoid pitfalls.Chemistry of Materials, 34(17): 7650–7665, 2022

Reference 5

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source=pdf_text observed=2026-08-06T22:45:49.269793Z digest=sha256:032fd2b6228ea09e8d4bf2b577974af7f5afccaa1fe3f5beec7f5b0481d36016

Observation daf25ad4-a0bf-495b-8005-def41ca670cf · outbound

This paper cites Scope of machine learning in materials research—a review.Applied Surface Science Advances, 18:100523, 2023.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools Scope of machine learning in materials research—a review.Applied Surface Science Advances, 18:100523, 2023

Reference 6

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source=pdf_text observed=2026-08-06T22:45:49.310184Z digest=sha256:99df6ba3bb40dfa97c5ce86dc721734b81d4aa6c0bb1f35687c6859ef820f64b

Observation 3e484c85-3b16-4d86-83f8-767477e8eb0f · outbound

This paper cites Bert: Pre-training of deep bidirectional transformers for language understanding.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools Bert: Pre-training of deep bidirectional transformers for language understanding

Reference 7

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source=pdf_text observed=2026-08-06T22:45:49.407677Z digest=sha256:9acddcb09997b962b8de204af607904816a25d33a0d11e88156776d100146a03

Observation 18eafc7f-dc03-47fd-bc76-7b8cd0b0b35e · outbound

This paper cites Language models are unsupervised multitask learners.OpenAI blog, 1(8):9, 2019.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools Language models are unsupervised multitask learners.OpenAI blog, 1(8):9, 2019

Reference 8

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source=pdf_text observed=2026-08-06T22:45:49.466208Z digest=sha256:d940314e7ce4908802c58f42c2dec5a3260486d2350698301341bacf1ec84a3e

Observation f7c1976f-8591-45c8-99b2-af8564e4e6c6 · outbound

This paper cites Language models are few-shot learners.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools Language models are few-shot learners

Reference 9

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source=pdf_text observed=2026-08-06T22:45:49.557945Z digest=sha256:109b6baa0db04d7d658b482521762e191ee0f886f116a2e9a221be83aa75bef9

Observation f003670e-ecb4-4e43-aee3-750bb56e4993 · outbound

This paper cites GPT-4 Technical Report.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools GPT-4 Technical Report

Reference 10

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source=pdf_text observed=2026-08-06T22:45:49.650742Z digest=sha256:c040bbc3feda1d4adb3a553c4f37e4173574dd24665872aaa7050b683f4f57fc

Observation 592669b5-2cae-4d1f-a682-df699c04fe9b · outbound

This paper cites Palm: Scaling language modeling with pathways.Journal of Machine Learning Research, 24(240):1–113, 2023.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools Palm: Scaling language modeling with pathways.Journal of Machine Learning Research, 24(240):1–113, 2023

Reference 11

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source=pdf_text observed=2026-08-06T22:45:49.744243Z digest=sha256:c4d1952712b7792c438f44f4002cfd65a9226f29884286c8e9e727572ad972ea

Observation 96278f75-5473-46c6-be09-19f3077321e4 · outbound

This paper cites Learning transferable visual models from natural language supervision.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools Learning transferable visual models from natural language supervision

Reference 12

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source=pdf_text observed=2026-08-06T22:45:49.814048Z digest=sha256:7ea31fe1f36a88dd169b97af6a57e8930fd45ae9a613d24e88b849f7b8992d10

Observation a3e4ee5b-5262-4761-a74f-6845de595cfd · outbound

This paper cites Emerging properties in self-supervised vision transformers.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools Emerging properties in self-supervised vision transformers

Reference 13

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source=pdf_text observed=2026-08-06T22:45:49.906861Z digest=sha256:1bdb70b4ccc89e651c7887dc1ffc85e47f886883d43fb6a479db5059429788b1

Observation b9b6a810-4441-4cbf-84c2-efa320cb212b · outbound

This paper cites Scaling deep learning for materials discovery.Nature, 624(7990):80–85, 2023.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools Scaling deep learning for materials discovery.Nature, 624(7990):80–85, 2023

Reference 14

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source=pdf_text observed=2026-08-06T22:45:49.981683Z digest=sha256:1c444fbcd9f57394b8095f753ffaccddaafe34578b24f566d57fe501a5a99446

Observation fc9edab3-c646-4fec-a8bd-492f73d349d4 · outbound

This paper cites MatterSim: A Deep Learning Atomistic Model Across Elements, Temperatures and Pressures.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools MatterSim: A Deep Learning Atomistic Model Across Elements, Temperatures and Pressures

Reference 15

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source=pdf_text observed=2026-08-06T22:45:50.063999Z digest=sha256:deddd1148a50fbfa36b7d22d60fe2547d702889cade25dbd5cbad2bb945238eb

Observation 8778ab22-6165-4dbf-ac38-38885a8333c1 · outbound

This paper cites A foundation model for atomistic materials chemistry.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools A foundation model for atomistic materials chemistry

Reference 16

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source=pdf_text observed=2026-08-06T22:45:50.114085Z digest=sha256:13e0ed07d013d03a1b83f62b0968b563f80156c337cb99cc296403956e2532c0

Observation 6b0514c8-f340-42c9-a1ec-706b5f82bb56 · outbound

This paper cites MatterGen: a generative model for inorganic materials design.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools MatterGen: a generative model for inorganic materials design

Reference 17

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source=pdf_text observed=2026-08-06T22:45:50.199192Z digest=sha256:93748a91f755236e2e888133c5e30a248aadd0f7efd051eee1109292fd8d5de4

Observation 3a852c62-0e41-48e2-b91a-89f8c571f5e2 · outbound

This paper cites Space Group Constrained Crystal Generation.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools Space Group Constrained Crystal Generation

Reference 18

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source=pdf_text observed=2026-08-06T22:45:50.263429Z digest=sha256:0254093283a46b9a62d807c641ec57560dde9363a05925ccdd31d26327d522c0

Observation d5a34b86-2e8f-4fee-b4c3-efa37ffa92e2 · outbound

This paper cites Space group informed transformer for crystalline materials generation.arXiv preprint arXiv:2403.15734, 2024.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools Space group informed transformer for crystalline materials generation.arXiv preprint arXiv:2403.15734, 2024

Reference 19

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source=pdf_text observed=2026-08-06T22:45:50.309363Z digest=sha256:c9b9c486fab334cde6f3331522e66055ced21598a908d83f51548bf420eedf77

Observation 962ebd04-fd39-4f6d-95c8-4f7bcefc6fb7 · outbound

This paper cites nach0: multimodal natural and chemical languages foundation model.Chemical Science, 15(22):8380–8389, 2024.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools nach0: multimodal natural and chemical languages foundation model.Chemical Science, 15(22):8380–8389, 2024

Reference 20

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source=pdf_text observed=2026-08-06T22:45:50.371459Z digest=sha256:162a0977c561c999f3e39dc23a26377d83fbec2a6105fca29bd4c8bb51137092

Observation bdaf4384-18ec-4824-8555-dbbe5500086b · outbound

This paper cites Multimodal foundation models for material property prediction and discovery.Newton, 2025.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools Multimodal foundation models for material property prediction and discovery.Newton, 2025

Reference 21

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source=pdf_text observed=2026-08-06T22:45:50.433371Z digest=sha256:9a25d23c26b8c53fa5aa9a04d895ce533bbe35187cef6a31516cd0d01ffa9a89

Observation 31273d3d-26ef-4641-8961-5846f501f74b · outbound

This paper cites MatterChat: A Multi-Modal LLM for Material Science.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools MatterChat: A Multi-Modal LLM for Material Science

Reference 22

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source=pdf_text observed=2026-08-06T22:45:50.476132Z digest=sha256:13394cbef73a898d526e7b5bc1280e1f81e47c9f3e241c5d3cb77aeade4e5350

Observation 2062caa3-5286-43c5-8524-2ab43890a0bf · outbound

This paper cites ATLANTIC: Structure-Aware Retrieval-Augmented Language Model for Interdisciplinary Science.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools ATLANTIC: Structure-Aware Retrieval-Augmented Language Model for Interdisciplinary Science

Reference 23

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source=pdf_text observed=2026-08-06T22:45:50.531047Z digest=sha256:af61daa229f0676bf5f154afcd2d3304987fef2248775e001d37648296602ca4

Observation 4c58933b-7a4e-423f-93c8-ae4fb9753856 · outbound

This paper cites Crystal structure generation with autoregressive large language modeling.Nature Communications, 15(1):1–16, 2024.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools Crystal structure generation with autoregressive large language modeling.Nature Communications, 15(1):1–16, 2024

Reference 24

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source=pdf_text observed=2026-08-06T22:45:50.596388Z digest=sha256:f358074b89aad3cf407af197b2ccb6da27bfed343a406ff54cc6fd5d021a9b57

Observation ff129ba8-3784-4054-a0e1-498b71e34163 · outbound

This paper cites Accelerating material design with the generative toolkit for scientific discovery.npj Computational Materials, 9(1):69, 2023.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools Accelerating material design with the generative toolkit for scientific discovery.npj Computational Materials, 9(1):69, 2023

Reference 25

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source=pdf_text observed=2026-08-06T22:45:50.644106Z digest=sha256:3ea1fd3328824c7610eea584e81a68535df433e3ba8de5fe977d6fced16e22a3

Observation 9d77f4c0-6808-47cc-bfa4-6fd676c8b49a · outbound

This paper cites An autonomous laboratory for the accelerated synthesis of novel materials.Nature, 624(7990):86–91, 2023.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools An autonomous laboratory for the accelerated synthesis of novel materials.Nature, 624(7990):86–91, 2023

Reference 26

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source=pdf_text observed=2026-08-06T22:45:50.714674Z digest=sha256:d0fbb83592442fd863d12d019ed6dd93ef341234374d01423ca4ffebc8f41802

Observation ee437606-14b5-4f10-b659-f74905bc54b3 · outbound

This paper cites Developing a Foundation Model for Predicting Material Failure.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools Developing a Foundation Model for Predicting Material Failure

Reference 27

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local_arxiv, observed 2026-08-06T22:46:01.859232Z

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No event found in the named queried sources as of 2026-08-08T06:32:00.761636+00:00.

source=pdf_text observed=2026-08-06T22:45:50.812450Z digest=sha256:fd46afe391792cba69150c0a0c77519d07b6b7bff70c891d057598a8460e0cc6

Observation db983615-41aa-488c-b55b-4ecf3bc09ae9 · outbound

This paper cites Foundation models for the process industry: Challenges and opportunities.Engineering, 2025.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools Foundation models for the process industry: Challenges and opportunities.Engineering, 2025

Reference 28

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source=pdf_text observed=2026-08-06T22:45:50.861191Z digest=sha256:aa3ff9aac90cb24f96b899222e7b15ea2d55442c64b58de26ced93bc6f8ff2d3

Observation 14104b6d-f2c1-43f9-b9d4-2a5ce7e1bef7 · outbound

This paper cites A perspective on foundation models in chemistry.JACS Au, 5(4):1499–1518, 2025.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools A perspective on foundation models in chemistry.JACS Au, 5(4):1499–1518, 2025

Reference 29

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source=pdf_text observed=2026-08-06T22:45:50.938616Z digest=sha256:d4c8fa1f7825e14e3ff149c2dbac1ede263e0528e53be5630c7776c8f7c00ac8

Observation 2ae85726-d864-4c6a-b640-f96da6fd4a9e · outbound

This paper cites Towards foundation models for materials science: The open matsci ml toolkit.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools Towards foundation models for materials science: The open matsci ml toolkit

Reference 30

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source=pdf_text observed=2026-08-06T22:45:51.011604Z digest=sha256:6492a8c43480df7d568c9461a1ac78dd58696548cd5827caf3ec7cbd65f27586

Observation 8d19c16e-07eb-440b-8563-f480d1e96e7c · outbound

This paper cites Atomgpt: Atomistic generative pretrained transformer for forward and inverse materials design.The Journal of Physical Chemistry Letters, 15(27):6909–6917, 2024.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools Atomgpt: Atomistic generative pretrained transformer for forward and inverse materials design.The Journal of Physical Chemistry Letters, 15(27):6909–6917, 2024

Reference 31

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source=pdf_text observed=2026-08-06T22:45:51.092693Z digest=sha256:2b16b6caf9d1c776307e0e624ebc4b63456dd68fbacc2db44552e475a3172769

Observation 88e40ee5-4dbb-4292-b5fc-7d3a091ba0d4 · outbound

This paper cites Multi-view mixture-of-experts for predicting molecular properties using smiles, selfies, and graph-based representations.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools Multi-view mixture-of-experts for predicting molecular properties using smiles, selfies, and graph-based representations

Reference 32

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source=pdf_text observed=2026-08-06T22:45:51.162993Z digest=sha256:91a184d9ebe801e918448c8ffcfbd9860768aa553e631a39630d5c677e83e6e2

Observation db604da4-a9e2-44e9-b7ee-a0753193b23d · outbound

This paper cites Developing ChemDFM as a large language foundation model for chemistry.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools Developing ChemDFM as a large language foundation model for chemistry

Reference 33

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source=pdf_text observed=2026-08-06T22:45:51.198241Z digest=sha256:961d59a5408a4c5a49d08c43b3d6e93800895ae431ff4b24a297086052a077dc

Observation de72df31-bb33-4798-b9c9-fcf4e62cf108 · outbound

This paper cites Foundational Large Language Models for Materials Research.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools Foundational Large Language Models for Materials Research

Reference 34

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source=pdf_text observed=2026-08-06T22:45:51.267103Z digest=sha256:642790c6a48a4b8c47ee8a7335b98e3ebd2e325a1f233d817be4cac4cfc7bf80

Observation 94d753fa-73f9-4295-a2c0-a5f8524eaa9c · outbound

This paper cites SCITUNE: Aligning Large Language Models with Human-Curated Scientific Multimodal Instructions.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools SCITUNE: Aligning Large Language Models with Human-Curated Scientific Multimodal Instructions

Reference 35

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source=pdf_text observed=2026-08-06T22:45:51.336005Z digest=sha256:b5273766d11e8f6ccdc79287b93d08f889365044e9ea35b7ca195288345c18cc

Observation 3955247d-bc47-40b9-9549-d521278cb1f0 · outbound

This paper cites HoneyComb: A Flexible LLM-Based Agent System for Materials Science.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools HoneyComb: A Flexible LLM-Based Agent System for Materials Science

Reference 36

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source=pdf_text observed=2026-08-06T22:45:51.422557Z digest=sha256:4afdb3274b0dd77e4e05f76d20c76a36557575978238498db35ac5aed5c0e032

Observation e54bd8bd-0364-4acf-b95c-69d2ebb3f8de · outbound

This paper cites LLMatDesign: Autonomous Materials Discovery with Large Language Models.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools LLMatDesign: Autonomous Materials Discovery with Large Language Models

Reference 37

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source=pdf_text observed=2026-08-06T22:45:51.562826Z digest=sha256:4d24982ffeb45eae48e9c55aa80f4e84132e76625c5e7702dbb0c41c2f36413d

Observation 3f757b0a-45ec-4f29-b173-c319fc680afc · outbound

This paper cites Chatmof: an artificial intelligence system for predicting and generating metal-organic frameworks using large language models.Nature communications, 15(1):4705, 2024.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools Chatmof: an artificial intelligence system for predicting and generating metal-organic frameworks using large language models.Nature communications, 15(1):4705, 2024

Reference 38

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source=pdf_text observed=2026-08-06T22:45:51.645891Z digest=sha256:fbac7a6c373a531210a1320d989f77352e752d87f1e6175743fbf1f97f2308f9

Observation da7aab8c-c223-44ce-abe6-1842f6a66e6f · outbound

This paper cites Matagent: A human-in-the-loop multi-agent llm framework for accelerating the material science discovery cycle.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools Matagent: A human-in-the-loop multi-agent llm framework for accelerating the material science discovery cycle

Reference 39

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source=pdf_text observed=2026-08-06T22:45:51.744821Z digest=sha256:f1c464cf1735a8c3e7b712334a43d4c51472525dc6ee8e7710ae5fc13aca74ef

Observation ce74b8bb-2990-40e5-8d7f-5a2294a8edea · outbound

This paper cites MatPilot: an LLM-enabled AI Materials Scientist under the Framework of Human-Machine Collaboration.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools MatPilot: an LLM-enabled AI Materials Scientist under the Framework of Human-Machine Collaboration

Reference 40

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source=pdf_text observed=2026-08-06T22:45:51.887367Z digest=sha256:31ca7d2f16d21069e0a44c5e5db2f5e6ccc7937f6b2c39af04c9716def580ac2

Observation 864dcd74-82b4-4b50-91fe-100865af5224 · outbound

This paper cites Bran, Sam Cox, Oliver Schilter, Carlo Baldassari, Andrew D White, and Philippe Schwaller.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools Bran, Sam Cox, Oliver Schilter, Carlo Baldassari, Andrew D White, and Philippe Schwaller

Reference 41

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source=pdf_text observed=2026-08-06T22:45:51.962834Z digest=sha256:8c16e1227b5ad148a4d4962afd964272cff86c0ec9489dc94e7aeaca5f53a977

Observation 7a40b8d1-c7c8-4be0-86ea-1fcbf9f908df · outbound

This paper cites The Open MatSci ML Toolkit: A Flexible Framework for Machine Learning in Materials Science.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools The Open MatSci ML Toolkit: A Flexible Framework for Machine Learning in Materials Science

Reference 42

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local_arxiv, observed 2026-08-06T22:46:01.739585Z

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source=pdf_text observed=2026-08-06T22:45:52.048784Z digest=sha256:6c93ef4ae2d332643a2163b5f6deeb85977ad3e3f39522997c25758bbcb58155

Observation 30c0005e-4e48-4578-85db-470ffeed9431 · outbound

This paper cites Forge: Pre-training open foundation models for science.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools Forge: Pre-training open foundation models for science

Reference 43

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source=pdf_text observed=2026-08-06T22:45:52.115548Z digest=sha256:751781c23be3e12af36d88514d28b30f1d771da92878abc44ba24ef85e872f21

Observation 6fd04638-fc6d-453f-9c4b-85cb398c9d2e · outbound

This paper cites Attention is all you need.Advances in neural information processing systems, 30, 2017.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools Attention is all you need.Advances in neural information processing systems, 30, 2017

Reference 44

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source=pdf_text observed=2026-08-06T22:45:52.194623Z digest=sha256:174fbc2c036969abb602777b0f3d770c7584470dce9870f8816984ff3195392a

Observation e5fb8f41-71fa-4009-98c0-9b2d8a3cb96f · outbound

This paper cites Improving language understanding by generative pre-training.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools Improving language understanding by generative pre-training

Reference 45

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source=pdf_text observed=2026-08-06T22:45:52.259198Z digest=sha256:af433a4512042fee135615ef39903e05c0b361549104837974345718033cb601

Observation 92f6daca-9fcb-457f-9ee2-c49e23813efa · outbound

This paper cites Gemini: A Family of Highly Capable Multimodal Models.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools Gemini: A Family of Highly Capable Multimodal Models

Reference 46

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source=pdf_text observed=2026-08-06T22:45:52.363980Z digest=sha256:8888b640552f64c273274e7ab254ab69acc2cd21a79d120c4d36e4b33dabafa6

Observation f0cd7433-6967-4f92-a450-34f5a650fddf · outbound

This paper cites LLaMA: Open and Efficient Foundation Language Models.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools LLaMA: Open and Efficient Foundation Language Models

Reference 47

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source=pdf_text observed=2026-08-06T22:45:52.427238Z digest=sha256:0737a6f24ed2a5e77b833e808cb35ac80b7c466487ad9eb5633ff36b0f43431d

Observation e7cbc9b0-bf05-4cce-9c63-84fd25b3cf1b · outbound

This paper cites BART: Denoising Sequence-to-Sequence Pre-training for Natural Language Generation, Translation, and Comprehension.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools BART: Denoising Sequence-to-Sequence Pre-training for Natural Language Generation, Translation, and Comprehension

Reference 48

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source=pdf_text observed=2026-08-06T22:45:52.499208Z digest=sha256:330103fff7de5ed81e4753a78d9cd6a824aa5135e3c84c2325a0945701ace741

Observation f44fbb91-8b9d-4e06-b166-3b33e11381a1 · outbound

This paper cites React: Synergizing reasoning and acting in language models.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools React: Synergizing reasoning and acting in language models

Reference 49

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source=pdf_text observed=2026-08-06T22:45:52.593830Z digest=sha256:8d899151c04c309d80944383bf4a15486eaf4a72cc10afa01b0c781b6607a362

Observation e974ae42-3cb5-4776-8281-e13aeb892ea3 · outbound

This paper cites Llm-planner: Few-shot grounded planning for embodied agents with large language models.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools Llm-planner: Few-shot grounded planning for embodied agents with large language models

Reference 50

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source=pdf_text observed=2026-08-06T22:45:52.670724Z digest=sha256:fdb205f0df5a582699d5f0838e4a85f47c137f01da991b8504ba6c29ce1f4efb

Observation 34a34422-22ac-4424-b66c-96ae23c277bf · outbound

This paper cites Tree of thoughts: Deliberate problem solving with large language models.Advances in neural information processing systems, 36:11809–11822, 2023.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools Tree of thoughts: Deliberate problem solving with large language models.Advances in neural information processing systems, 36:11809–11822, 2023

Reference 51

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source=pdf_text observed=2026-08-06T22:45:52.746077Z digest=sha256:3889bee7f6645cdf19149b09ab400bcf07408c8f51ccb95fd74aed68286da9fe

Observation 3ec49521-1b7a-4402-9cd0-2687d8ea5983 · outbound

This paper cites Language models as zero-shot planners: Extracting actionable knowledge for embodied agents.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools Language models as zero-shot planners: Extracting actionable knowledge for embodied agents

Reference 52

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source=pdf_text observed=2026-08-06T22:45:52.791319Z digest=sha256:328e841937a09566619f4ff0e3b549ee64b2d9db8a873c50eae6297d447f427b

Observation 3db051cc-f060-4333-ac85-9e32efa28e73 · outbound

This paper cites Evaluating Large Language Models in Theory of Mind Tasks.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools Evaluating Large Language Models in Theory of Mind Tasks

Reference 53

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source=pdf_text observed=2026-08-06T22:45:52.871383Z digest=sha256:0e81229a0d778bd497a99f5d1bd4d161966a79c3d08ef63267b376d8beff985e

Observation 77247bf9-b6ca-45a0-aa6a-efe6bab912f3 · outbound

This paper cites Role play with large language models.Nature, 623 (7987):493–498, 2023.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools Role play with large language models.Nature, 623 (7987):493–498, 2023

Reference 54

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source=pdf_text observed=2026-08-06T22:45:52.921416Z digest=sha256:db7fa23aad4d59e7c1219479afbda64a516d2732e76cb76f969607239682375f

Observation 8e36f138-d6d3-469f-852d-556d50bf106a · outbound

This paper cites A survey on large language model based autonomous agents.Frontiers of Computer Science, 18(6):186345, 2024.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools A survey on large language model based autonomous agents.Frontiers of Computer Science, 18(6):186345, 2024

Reference 55

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source=pdf_text observed=2026-08-06T22:45:53.046538Z digest=sha256:472d524109ccf9921d92d73196b9e8ee928eff59a8c542553052779e9c064cac

Observation c882da2a-ff03-43db-a930-b09979ed6be2 · outbound

This paper cites HoneyBee: Progressive Instruction Finetuning of Large Language Models for Materials Science.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools HoneyBee: Progressive Instruction Finetuning of Large Language Models for Materials Science

Reference 56

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local_arxiv, observed 2026-08-06T22:46:01.650991Z

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No event found in the named queried sources as of 2026-08-08T06:32:00.761636+00:00.

source=pdf_text observed=2026-08-06T22:45:53.164887Z digest=sha256:2c84f12b77ae6ea9e0e36d1e8bfdd66f1b1cb83a7c2d5f83407f0f63be782fa6

Observation eddafb64-7803-44c8-9d2d-9520e9d37d21 · outbound

This paper cites Crystal graph convolutional neural networks for an accurate and interpretable prediction of material properties.Physical review letters, 120(14):145301, 2018.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools Crystal graph convolutional neural networks for an accurate and interpretable prediction of material properties.Physical review letters, 120(14):145301, 2018

Reference 57

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source=pdf_text observed=2026-08-06T22:45:53.257495Z digest=sha256:3310a81b1016ffc35329fe2920818d2df580d330066034610652114018f74ec9

Observation 92612b4b-833c-4864-a93c-74132de4649f · outbound

This paper cites Graph networks as a universal machine learning framework for molecules and crystals.Chemistry of Materials, 31(9):3564–3572, 2019.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools Graph networks as a universal machine learning framework for molecules and crystals.Chemistry of Materials, 31(9):3564–3572, 2019

Reference 58

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source=pdf_text observed=2026-08-06T22:45:53.400425Z digest=sha256:495275c0e7e071e27ff79a8f9f03ba5aa3f77d07e2d56140ef7fa944c78356c5

Observation 93c3fda0-bf1b-422c-8c9c-6b2e9428a3c8 · outbound

This paper cites Catalyst energy prediction with catberta: Unveiling feature exploration strategies through large language models.ACS Catalysis, 13(24):16032–16044, 2023.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools Catalyst energy prediction with catberta: Unveiling feature exploration strategies through large language models.ACS Catalysis, 13(24):16032–16044, 2023

Reference 59

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source=pdf_text observed=2026-08-06T22:45:53.535233Z digest=sha256:2859565b5220f13f81800896daf6324082a3acf74637d3853c4f53e0c8e66334

Observation ddffe5e8-10d5-4d5c-8c55-ab2bccbed9a1 · outbound

This paper cites MolXPT: Wrapping Molecules with Text for Generative Pre-training.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools MolXPT: Wrapping Molecules with Text for Generative Pre-training

Reference 60

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source=pdf_text observed=2026-08-06T22:45:53.648250Z digest=sha256:3b13012b3229bf8e0bc6edbba0bffb25e2f6cc2d4901088e179243a343fdbe3e

Observation 125f0c09-4390-4b95-aaec-dc00b93dd9ad · outbound

This paper cites Crystal Diffusion Variational Autoencoder for Periodic Material Generation.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools Crystal Diffusion Variational Autoencoder for Periodic Material Generation

Reference 61

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source=pdf_text observed=2026-08-06T22:45:53.799738Z digest=sha256:e2decaccd551549c8362092e540e3b1e999a44ea3179e9ea240fc20a7bb9da35

Observation bdce9d7e-03e9-467d-8db8-72214f82b27c · outbound

This paper cites Crystal structure prediction by joint equivariant diffusion.Advances in Neural Information Processing Systems, 36:17464–17497, 2023.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools Crystal structure prediction by joint equivariant diffusion.Advances in Neural Information Processing Systems, 36:17464–17497, 2023

Reference 62

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source=pdf_text observed=2026-08-06T22:45:53.938840Z digest=sha256:f7b648ade4fee9e17132e7f30b15c4e9ff634d8b091eedf0287c52117f1cd79b

Observation 89f6ccfc-f768-4d46-a89c-ca8e535a493a · outbound

This paper cites GP-MoLFormer: A Foundation Model For Molecular Generation.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools GP-MoLFormer: A Foundation Model For Molecular Generation

Reference 63

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source=pdf_text observed=2026-08-06T22:45:54.037903Z digest=sha256:1d21ae7aa7ab902f06963d60a30148429b0179bf2cd4031aaac429698c088c17

Observation 5f260832-e7a6-402f-ab3a-b1f88b3cfe2e · outbound

This paper cites MatterGPT: A Generative Transformer for Multi-Property Inverse Design of Solid-State Materials.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools MatterGPT: A Generative Transformer for Multi-Property Inverse Design of Solid-State Materials

Reference 64

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source=pdf_text observed=2026-08-06T22:45:54.140188Z digest=sha256:1a9e7ed1f171bd36c70cbcae34cdb2025030b42061103442167bc9b4b9267fcc

Observation 877b84a4-dc8b-44ed-88f7-6d1a2ce05a65 · outbound

This paper cites Chemformer: a pre-trained transformer for computational chemistry.Machine Learning: Science and Technology, 3(1):015022, 2022.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools Chemformer: a pre-trained transformer for computational chemistry.Machine Learning: Science and Technology, 3(1):015022, 2022

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source=pdf_text observed=2026-08-06T22:45:54.242408Z digest=sha256:0f11eb7c59f81488573b0a939d129a715494cc3060b0183cc60a2e42a0ace554

Observation 81dd21de-4f72-46f5-ac42-bd4d9aea8eca · outbound

This paper cites Flowllm: Flow matching for material generation with large language models as base distributions.Advances in Neural Information Processing Systems, 37:46025–46046, 2024.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools Flowllm: Flow matching for material generation with large language models as base distributions.Advances in Neural Information Processing Systems, 37:46025–46046, 2024

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source=pdf_text observed=2026-08-06T22:45:54.397001Z digest=sha256:6fde045dca78405a0d653ffa889ac06c3c77f24f6cf2b1e6a44e9f11befdf84c

Observation 53e55b7f-3144-4f95-bc89-1fb8e0dbb6be · outbound

This paper cites Is Large Language Model All You Need to Predict the Synthesizability and Precursors of Crystal Structures?.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools Is Large Language Model All You Need to Predict the Synthesizability and Precursors of Crystal Structures?

Reference 67

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local_arxiv, observed 2026-08-06T22:46:01.561043Z

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No event found in the named queried sources as of 2026-08-08T06:32:00.761636+00:00.

source=pdf_text observed=2026-08-06T22:45:54.508214Z digest=sha256:9301a4a8f722bc432282d5e1aae7d70f7965d2fa4cfc318a244c369887e730bf

Observation a028b6b1-4f19-49ba-8d58-59289ea6da14 · outbound

This paper cites LLM-Fusion: A Novel Multimodal Fusion Model for Accelerated Material Discovery.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools LLM-Fusion: A Novel Multimodal Fusion Model for Accelerated Material Discovery

Reference 68

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source=pdf_text observed=2026-08-06T22:45:54.611509Z digest=sha256:e906724f93e96430585c5fece1f927736685094efe5d2a4f9b7a1b8f68c13e36

Observation de484a9c-3e0f-495c-abd9-9c1a1db39feb · outbound

This paper cites Unifying molecular and textual representations via multi-task language modelling.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools Unifying molecular and textual representations via multi-task language modelling

Reference 69

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source=pdf_text observed=2026-08-06T22:45:54.771536Z digest=sha256:26c47cb383f9dfefde717cffc12b88dc9b9382a107d86e2d82f75a2abfb5e3d7

Observation 72c25cbe-bfff-4d1c-8040-6a0c691622e3 · outbound

This paper cites Quantifying the advantage of domain-specific pre-training on named entity recognition tasks in materials science.Patterns, 3(4), 2022.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools Quantifying the advantage of domain-specific pre-training on named entity recognition tasks in materials science.Patterns, 3(4), 2022

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source=pdf_text observed=2026-08-06T22:45:54.925336Z digest=sha256:14092803a1acd47ad63c2c23ea8c615f452733fe2109172190ec9337f380c63c

Observation 8860ba84-43ae-4137-a0d2-034640b0fd92 · outbound

This paper cites Matscibert: A materials domain language model for text mining and information extraction.npj Computational Materials, 8(1):102, 2022.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools Matscibert: A materials domain language model for text mining and information extraction.npj Computational Materials, 8(1):102, 2022

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Observation d6348a59-d30c-4a5c-99a2-4685e0d17b16 · outbound

This paper cites A general-purpose material property data extraction pipeline from large polymer corpora using natural language processing.npj Computational Materials, 9(1):52, 2023.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools A general-purpose material property data extraction pipeline from large polymer corpora using natural language processing.npj Computational Materials, 9(1):52, 2023

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source=pdf_text observed=2026-08-06T22:45:55.193413Z digest=sha256:571206be97afdc8c3dc3c7361adf2a01ae39e8cfcadc25fd913fe912cfcadd19

Observation c652167d-9bc8-494d-b13d-0db67c566682 · outbound

This paper cites Molscribe: robust molecular structure recognition with image-to-graph generation.Journal of Chemical Information and Modeling, 63(7):1925–1934, 2023.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools Molscribe: robust molecular structure recognition with image-to-graph generation.Journal of Chemical Information and Modeling, 63(7):1925–1934, 2023

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source=pdf_text observed=2026-08-06T22:45:55.330128Z digest=sha256:80cbc6ffc44a0c1d244d2f8d64bef010acdc88ecdb94e204a3c1fd9d5b02bda5

Observation 83a5b0ae-e232-422b-9490-08a87f2f54ab · outbound

This paper cites DePlot: One-shot visual language reasoning by plot-to-table translation.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools DePlot: One-shot visual language reasoning by plot-to-table translation

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source=pdf_text observed=2026-08-06T22:45:55.410946Z digest=sha256:cdf2ff3ac489d4800608e0cacc53a21c343a67f903890232d9216f801cda7b63

Observation 248367ef-bf4e-4f3c-ac39-214dc973adc3 · outbound

This paper cites Mascqa: investigating materials science knowledge of large language models.Digital Discovery, 3(2):313–327, 2024.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools Mascqa: investigating materials science knowledge of large language models.Digital Discovery, 3(2):313–327, 2024

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source=pdf_text observed=2026-08-06T22:45:55.477279Z digest=sha256:ed382b930e902d750d8c1d8dfecdeff30218f4aba16c10a689390d185ea637e3

Observation 850b9e21-d4ec-400b-9678-6838fbd07a53 · outbound

This paper cites Assessment of fine-tuned large language models for real-world chemistry and material science applications.Chemical science, 16(2):670–684, 2025.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools Assessment of fine-tuned large language models for real-world chemistry and material science applications.Chemical science, 16(2):670–684, 2025

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source=pdf_text observed=2026-08-06T22:45:55.551437Z digest=sha256:0b988bd93e976af1857de26f6810f1a4581a9c9bcc9cfc4ef89f35a880dd02cb

Observation 492b5158-2234-4f0c-9eb2-234cba9797d7 · outbound

This paper cites Gpt-j-6b: A 6 billion parameter autoregressive language model, 2021.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools Gpt-j-6b: A 6 billion parameter autoregressive language model, 2021

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source=pdf_text observed=2026-08-06T22:45:55.650008Z digest=sha256:fe398678fefd795ddb202eccb208022a2643278c5b7862568debb6c19f46b252

Observation 23c553ec-7b33-4346-b63e-55c7231a0671 · outbound

This paper cites The Llama 3 Herd of Models.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools The Llama 3 Herd of Models

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source=pdf_text observed=2026-08-06T22:45:55.730130Z digest=sha256:ed7959e24038ee8d825172deb44b2f5f9c19cdafed806ed4717bb14cc76402c2

Observation 05b99a8b-a83f-4b8a-b3ac-0814cb5e8262 · outbound

This paper cites Mistral 7B.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools Mistral 7B

Reference 79

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source=pdf_text observed=2026-08-06T22:45:55.792600Z digest=sha256:d9cdf37647925691c9674375432e3b8ac609daa9f78893759f09e8598604e5ed

Observation 5bcbda94-a38e-472f-9045-f457d098933a · outbound

This paper cites Smiles, a chemical language and information system.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools Smiles, a chemical language and information system

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source=pdf_text observed=2026-08-06T22:45:55.908626Z digest=sha256:636f92eda506ef230305d47e664c35a6adf202189d83c010a164403861980c16

Observation 124f8404-92a4-49ad-9188-80f421c1b2f3 · outbound

This paper cites Uni-SMART: Universal Science Multimodal Analysis and Research Transformer.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools Uni-SMART: Universal Science Multimodal Analysis and Research Transformer

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source=pdf_text observed=2026-08-06T22:45:56.001030Z digest=sha256:119f8b0a335a0a357a2a27477bbd2e09766d40da643c2d13dad3a9a68a9fd4e8

Observation 099be7b0-622a-413d-95ba-d98da1c0289b · outbound

This paper cites The claude 3 model family: Opus, sonnet, haiku.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools The claude 3 model family: Opus, sonnet, haiku

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source=pdf_text observed=2026-08-06T22:45:56.069072Z digest=sha256:b21ba988020f92e5763cb7b40e28ab9971bb744bd01aad505a852825fe3b9b11

Observation 07feffc6-4759-4837-a162-d560c75f8a85 · outbound

This paper cites Do transformers really perform badly for graph representation?Advances in neural information processing systems, 34:28877–28888, 2021.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools Do transformers really perform badly for graph representation?Advances in neural information processing systems, 34:28877–28888, 2021

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source=pdf_text observed=2026-08-06T22:45:56.164059Z digest=sha256:500ed33604fe66285dd95c48a9b4160d773aa66de04ca743de679aaedd438c64

Observation 66d1c0d4-22c3-45c8-b753-8d122c28df05 · outbound

This paper cites Mace: Higher order equivariant message passing neural networks for fast and accurate force fields.Advances in neural information processing systems, 35:11423–11436, 2022.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools Mace: Higher order equivariant message passing neural networks for fast and accurate force fields.Advances in neural information processing systems, 35:11423–11436, 2022

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source=pdf_text observed=2026-08-06T22:45:56.232681Z digest=sha256:4e8ceafffa77fe9b9f4a5a3c413f79472962eb1d4aa514d2e71c73ebd02d4234

Observation fb7e1593-fd00-40df-851e-ddf34d687953 · outbound

This paper cites Ani-1: an extensible neural network potential with dft accuracy at force field computational cost.Chemical science, 8(4):3192–3203, 2017.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools Ani-1: an extensible neural network potential with dft accuracy at force field computational cost.Chemical science, 8(4):3192–3203, 2017

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source=pdf_text observed=2026-08-06T22:45:56.348327Z digest=sha256:1d947f7395d45983c0919ec9e3a47e831db01387874432ea9809d5f9a5892ccd

Observation c886f328-1c0f-4504-827d-5b379decfbea · outbound

This paper cites Generalized neural-network representation of high-dimensional potential- energy surfaces.Physical review letters, 98(14):146401, 2007.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools Generalized neural-network representation of high-dimensional potential- energy surfaces.Physical review letters, 98(14):146401, 2007

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source=pdf_text observed=2026-08-06T22:45:56.447586Z digest=sha256:aeb9be57433eb06c24d275b2b6235f08f6e252e814406a89b5a6a7a5c0e6e330

Observation 6e2e015a-fa79-4b35-9034-4dafcf065d75 · outbound

This paper cites Accurate and transferable multitask prediction of chemical properties with an atoms-in-molecules neural network.Science advances, 5(8):eaav6490, 2019.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools Accurate and transferable multitask prediction of chemical properties with an atoms-in-molecules neural network.Science advances, 5(8):eaav6490, 2019

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source=pdf_text observed=2026-08-06T22:45:56.540743Z digest=sha256:642ec3f40a32a59f4a0852d626b1c7f206339b76c6e1f598adc4603455776a49

Observation deda823a-f9ca-4085-a205-ee77d3d2a412 · outbound

This paper cites Aimnet2: a neural network potential to meet your neutral, charged, organic, and elemental-organic needs.Chemical Science, 2025.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools Aimnet2: a neural network potential to meet your neutral, charged, organic, and elemental-organic needs.Chemical Science, 2025

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source=pdf_text observed=2026-08-06T22:45:56.654888Z digest=sha256:de87fdc1f37ecd00bec96e1d0ac857de68255d1baf7a9c531955eb118ede154a

Observation 2cd0e5d7-16e8-43aa-94b6-0ec39a5a6b4d · outbound

This paper cites The graph neural network model.IEEE transactions on neural networks, 20(1):61–80, 2008.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools The graph neural network model.IEEE transactions on neural networks, 20(1):61–80, 2008

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source=pdf_text observed=2026-08-06T22:45:56.719996Z digest=sha256:110d14ee4a8c47df92be331d49aebbf0a711377f79d797863fd606dbd7127ae4

Observation 1798da98-80b4-4601-a9da-e7ac9d6a09ed · outbound

This paper cites Self-referencing embedded strings (selfies): A 100% robust molecular string representation.Machine Learning: Science and Technology, 1(4):045024, 2020.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools Self-referencing embedded strings (selfies): A 100% robust molecular string representation.Machine Learning: Science and Technology, 1(4):045024, 2020

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source=pdf_text observed=2026-08-06T22:45:56.808611Z digest=sha256:b3927e6d284b40395e460970f33d76b7d74a8a9ba3b20c66e949106bccaa2378

Observation 02007e70-d8a0-4ee0-9476-d7aafa5d6119 · outbound

This paper cites Zinc 15–ligand discovery for everyone.Journal of chemical information and modeling, 55(11):2324–2337, 2015.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools Zinc 15–ligand discovery for everyone.Journal of chemical information and modeling, 55(11):2324–2337, 2015

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source=pdf_text observed=2026-08-06T22:45:56.877984Z digest=sha256:ba61be79586633c5e32979c42311d4612f6e6b3ddcec8c1dd47d575779d61de8

Observation 932be6fe-ec6c-4f7c-a75a-ebfdb1e46b79 · outbound

This paper cites Zinc20—a free ultralarge-scale chemical database for ligand discovery.Journal of chemical information and modeling, 60(12):6065–6073, 2020.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools Zinc20—a free ultralarge-scale chemical database for ligand discovery.Journal of chemical information and modeling, 60(12):6065–6073, 2020

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source=pdf_text observed=2026-08-06T22:45:56.964415Z digest=sha256:e48941ee4eb92088913752f79f9796d6dc27b923747780da4aa90213249dbb7d

Observation b5f04dc2-41b3-496d-b45b-14ad2253c7be · outbound

This paper cites The chembl database in 2023: a drug discovery platform spanning multiple bioactivity data types and time periods.Nucleic acids research, 52(D1): D1180–D1192, 2024.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools The chembl database in 2023: a drug discovery platform spanning multiple bioactivity data types and time periods.Nucleic acids research, 52(D1): D1180–D1192, 2024

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source=pdf_text observed=2026-08-06T22:45:57.030908Z digest=sha256:a161b5ae4a3071ca9ec817cfca790d60280270919a6bde4ca200ba47b1b03c24

Observation 02b087c5-d218-4fab-9b2b-ba267792a9f7 · outbound

This paper cites Chembl web services: streamlining access to drug discovery data and utilities.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools Chembl web services: streamlining access to drug discovery data and utilities

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source=pdf_text observed=2026-08-06T22:45:57.099822Z digest=sha256:9d5bf54ea6ec8b8a09edcee5f765358ea74b7046a497ba817118d489f3576b36

Observation e78b9df7-d785-4384-ad5e-2bf67253329f · outbound

This paper cites Schnet–a deep learning architecture for molecules and materials.The Journal of Chemical Physics, 148(24), 2018.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools Schnet–a deep learning architecture for molecules and materials.The Journal of Chemical Physics, 148(24), 2018

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source=pdf_text observed=2026-08-06T22:45:57.179816Z digest=sha256:8ccd48b0dd8a21c1426c2710bbda96acde2e32a9287221a90eeafc98c0c77962

Observation c409da0a-d472-4877-a9ce-6dd4a16046fc · outbound

This paper cites Commentary: The materials project: A materials genome approach to accelerating materials innovation.APL materials, 1(1), 2013.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools Commentary: The materials project: A materials genome approach to accelerating materials innovation.APL materials, 1(1), 2013

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source=pdf_text observed=2026-08-06T22:45:57.228598Z digest=sha256:400c2ed65228a0ae950749d94650598b635d8ad6a50d2647777cb510d4825b4e

Observation c4be6679-2617-42fb-9cdb-dafb40f4a399 · outbound

This paper cites Enumeration of 166 billion organic small molecules in the chemical universe database gdb-17.Journal of chemical information and modeling, 52(11):2864–2875, 2012.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools Enumeration of 166 billion organic small molecules in the chemical universe database gdb-17.Journal of chemical information and modeling, 52(11):2864–2875, 2012

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source=pdf_text observed=2026-08-06T22:45:57.311642Z digest=sha256:59928326667c22b89bf6a8f1c329b0498b117550e73b5e44b097a2db69a03b7e

Observation 091dcb15-506a-46c9-a82c-d63d9b142b46 · outbound

This paper cites Quantum chemistry structures and properties of 134 kilo molecules.Scientific data, 1(1):1–7, 2014.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools Quantum chemistry structures and properties of 134 kilo molecules.Scientific data, 1(1):1–7, 2014

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source=pdf_text observed=2026-08-06T22:45:57.380541Z digest=sha256:089819a90d2d27e80963cc3a07e2c4db4fcaf93e82f00d0eec13f4177d5cdf56

Observation f0d9f27f-4076-4c48-9572-3c479ca20568 · outbound

This paper cites A compact review of molecular property prediction with graph neural networks.Drug Discovery Today: Technologies, 37:1–12, 2020.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools A compact review of molecular property prediction with graph neural networks.Drug Discovery Today: Technologies, 37:1–12, 2020

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source=pdf_text observed=2026-08-06T22:45:57.421724Z digest=sha256:275b1d78f0715ad7c179dd70fbac6762e61ded3827740e0ec8f1db0286d34566

Observation e3c972b3-5b69-4c08-a5a8-a3d823334119 · outbound

This paper cites ChemBERTa: Large-Scale Self-Supervised Pretraining for Molecular Property Prediction.

A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools ChemBERTa: Large-Scale Self-Supervised Pretraining for Molecular Property Prediction

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source=pdf_text observed=2026-08-06T22:45:57.493434Z digest=sha256:ce2e875f0c214847f8ee25125a68156b0f30c245facae4b517981f7f559eee58

Pith citing papers

Observation fb115e51-6f44-4aed-83d7-db00cedcfdf8 · inbound

An Encoder-Decoder Foundation Chemical Language Model for Generative Polymer Design cites this paper.

An Encoder-Decoder Foundation Chemical Language Model for Generative Polymer Design A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools

Reference 5

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source=pdf_text observed=2026-08-04T08:48:26.638924Z digest=sha256:3ccbb94e67c7bbe496f9d2a19e4618a478b55e3211751baf550004f75f981763

Observation 51aa645c-fae6-4fa5-a76c-97b7b2b589f8 · inbound

SciAgentGym: Benchmarking Multi-Step Scientific Tool-use in LLM Agents cites this paper.

SciAgentGym: Benchmarking Multi-Step Scientific Tool-use in LLM Agents A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools

Reference 20

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source=pdf_text observed=2026-08-02T23:41:44.325186Z digest=sha256:db34b345f1c973419f5f3e1b0f7415ebe73165b785a1c3008a91f95b3dbbff13

Observation 45f94dee-6ed4-4db1-b62c-dc73acf0319d · inbound

RECIPER: A Dual-View Retrieval Pipeline for Procedure-Oriented Materials Question Answering cites this paper.

RECIPER: A Dual-View Retrieval Pipeline for Procedure-Oriented Materials Question Answering A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools

Reference 6

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arxiv_id, observed 2026-05-11T09:16:04.690204Z

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source=pdf_text observed=2026-05-10T16:07:18.732576Z digest=sha256:df7255dbf592ea8737767b40d317c597647154bf762b05d20b3823fbad59bb3e

Observation a409af16-0446-4735-a8b7-8090f9a846d8 · inbound

General-purpose LLMs as Constrained Crystal Composition Generators cites this paper.

General-purpose LLMs as Constrained Crystal Composition Generators A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools

Reference 19

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arxiv_id, observed 2026-07-01T19:56:11.230832Z

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No event found in the named queried sources as of 2026-08-08T06:32:00.761636+00:00.

source=pdf_text observed=2026-06-28T21:53:29.062019Z digest=sha256:66531b4b9944dc72974f07958cffc8888375ecc543836b6792f8d9e53dc9a438

Observation 38ef3b8f-fd53-4f9f-9abe-69019a8b3452 · inbound

Property Prediction of Stacked Bilayer Materials: A Multimodal Learning Approach cites this paper.

Property Prediction of Stacked Bilayer Materials: A Multimodal Learning Approach A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools

Reference 13

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arxiv_id, observed 2026-07-01T21:06:13.648123Z

Source-reported events for the cited work

No event found in the named queried sources as of 2026-08-08T06:32:00.761636+00:00.

source=pdf_text observed=2026-06-28T17:30:28.329639Z digest=sha256:59f94affeedbcad25aac2158637405ec93a95ad173841b869ac0effad82de466

Observation 08ff4769-c6ed-4edc-b29d-2d5ccbb8f7c2 · inbound

The evolution of AI from image interpretation toward scientific inference in nanoparticle electron microscopy cites this paper.

The evolution of AI from image interpretation toward scientific inference in nanoparticle electron microscopy A Survey of AI for Materials Science: Foundation Models, LLM Agents, Datasets, and Tools

Reference 37

Resolution
unresolved
no resolver link, observed 2026-07-14T12:06:28.342674Z

Source-reported events for the cited work

Unavailable: canonical work link unavailable.

source=pdf_text observed=2026-07-14T12:06:28.342674Z digest=sha256:55d79ff9a574ad93247bfc648b0aa45a4b5ef17d7f384fc79a1ed8e3c67ebffc