The AI-ready collaborative platform driving the #DigitalTransformation of #materials and #chemicals R&D through #modeling and #machinelearning.

Joined November 2018
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4 Feb 2022
Twitter Welcome to the Era of Digitally-Engineered Mat3rials! Thank you @WSJ @newsient for sharing the news about our $3M seed round, solid growth how our platform accelerates #RnD of #materials and #chemicals! ow.ly/VprM50HMwJM
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โšก๏ธ ๐—ฅ๐—ฒ๐—น๐—ฒ๐—ฎ๐˜€๐—ฒ ๐Ÿฎ๐Ÿฌ๐Ÿฎ๐Ÿฒ.๐Ÿฑ.๐Ÿฎ๐Ÿด ๐—ต๐—ถ๐—ด๐—ต๐—น๐—ถ๐—ด๐—ต๐˜๐˜€ - ๐—ฆ๐˜‚๐—ฟ๐—ณ๐—ฎ๐—ฐ๐—ฒ ๐—˜๐—ป๐—ฒ๐—ฟ๐—ด๐˜† ๐—ช๐—ผ๐—ฟ๐—ธ๐—ณ๐—น๐—ผ๐˜„ ๐˜‚๐—ฝ๐—ฑ๐—ฎ๐˜๐—ฒ๐—ฑ. ๐—ฅ๐—ฒ๐˜‚๐˜€๐—ฎ๐—ฏ๐—น๐—ฒ ๐—ก๐—ผ๐˜๐—ฒ๐—ฏ๐—ผ๐—ผ๐—ธ๐˜€ ๐—ณ๐—ผ๐—ฟ ๐—ฆ๐˜‚๐—ฟ๐—ณ๐—ฎ๐—ฐ๐—ฒ ๐—˜๐—ป๐—ฒ๐—ฟ๐—ด๐˜† ๐—ฎ๐—ป๐—ฑ ๐—˜๐—พ๐˜‚๐—ฎ๐˜๐—ถ๐—ผ๐—ป ๐—ผ๐—ณ ๐—ฆ๐˜๐—ฎ๐˜๐—ฒ In scientific computing, the most valuable workflows are often not the flashy ones. They are the ones people reuse again and again. That is why the addition of new notebooks for Surface Energy and Equation of State is more important than it may first appear. These are foundational calculations in materials modeling, and turning them into reusable notebook workflows makes them easier to teach, compare, review, and apply across multiple systems. This becomes even more useful when workflow metadata can be reused. The update to the Surface Energy workflow, which now reuses build metadata from mat3ra-made, points in that direction. The practical value is clear: easier comparison of related systems, more consistent reuse of setup information, better transparency for review and collaboration, and smoother transfer from one material system to another. In research, a workflow that works once is not enough. A workflow that can be repeated, adapted, and understood by others is far more valuable. Release page: mat3ra.com/news-and-blog-posโ€ฆ ๐Ÿ‘‰ Try it for free at mat3ra.com/?utm_source=twittโ€ฆ #SurfaceScience #EquationOfState #Jupyter #DFT #MaterialsScience
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โšก๏ธ ๐—ฅ๐—ฒ๐—น๐—ฒ๐—ฎ๐˜€๐—ฒ ๐Ÿฎ๐Ÿฌ๐Ÿฎ๐Ÿฒ.๐Ÿฑ.๐Ÿฎ๐Ÿด ๐—ต๐—ถ๐—ด๐—ต๐—น๐—ถ๐—ด๐—ต๐˜๐˜€ - ๐—ฝ๐—ฟ๐—ฒ-๐—ฟ๐—ฒ๐—น๐—ฎ๐˜… ๐˜€๐˜๐—ฟ๐˜‚๐—ฐ๐˜๐˜‚๐—ฟ๐—ฒ๐˜€ ๐˜„๐—ถ๐˜๐—ต ๐— ๐—Ÿ๐—™๐—™ ๐—ถ๐—ป ๐—๐˜‚๐—ฝ๐˜†๐˜๐—ฒ๐—ฟ๐—Ÿ๐—ถ๐˜๐—ฒ/๐—ฃ๐˜†๐—ผ๐—ฑ๐—ถ๐—ฑ๐—ฒ For many researchers, the hardest part of testing a new force field is not the model itself. It is everything around it: Python environments, dependencies, runtime setup, and infrastructure. That is why a notebook showing how to use the MACE universal forcefield in Jupyter and JupyterLite is such an interesting addition. The workflow demonstrates browser-based structural pre-relaxation with no extra infrastructure required. This is useful because it lowers the barrier to trying MLFF-based workflows, makes the setup steps visible and easier to learn, provides a lightweight path for education, testing, and early-stage validation, and creates a practical entry point before moving to larger compute environments. In many scientific settings, reducing the startup cost of a workflow is already a major improvement. A browser-based notebook does not replace production-scale infrastructure, but it makes the workflow easier to understand, test, and share. For anyone exploring pre-relaxation workflows before DFT, this is a very practical direction. Release page: mat3ra.com/news-and-blog-posโ€ฆ Related webinar resource: mat3ra.com/events-posts/mat3โ€ฆ ๐Ÿ‘‰ Try it for free at mat3ra.com/?utm_source=twittโ€ฆ #materials #RnD #mat3ra #exabyteio #materialsscience #materialsdesign #materialsmodeling #science #technology
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โš›๏ธ Mat3rials 3xplorer. ๐—œ๐—ป๐˜๐—ฒ๐—ฟ๐—ณ๐—ฎ๐—ฐ๐—ฒ ๐—ฏ๐—ฒ๐˜๐˜„๐—ฒ๐—ฒ๐—ป ๐—š๐—ฎ๐—น๐—น๐—ถ๐˜‚๐—บ ๐—”๐—ฟ๐˜€๐—ฒ๐—ป๐—ถ๐—ฑ๐—ฒ ๐—ฎ๐—ป๐—ฑ ๐—›๐—ฎ๐—ณ๐—ป๐—ถ๐˜‚๐—บ ๐—ข๐˜…๐—ถ๐—ฑ๐—ฒ (๐—š๐—ฎ๐—”๐˜€(๐Ÿฌ๐Ÿฌ๐Ÿญ)/๐—›๐—ณ๐—ข๐Ÿฎ(๐Ÿฌ๐Ÿฌ๐Ÿญ)), ๐Ÿฎ๐˜…๐Ÿฎ๐˜…๐Ÿญ ๐˜€๐˜๐—ฟ๐—ฎ๐—ถ๐—ป-๐—บ๐—ฎ๐˜๐—ฐ๐—ต๐—ถ๐—ป๐—ด ๐˜€๐˜‚๐—ฝ๐—ฒ๐—ฟ๐—ฐ๐—ฒ๐—น๐—น. This GaAs/HfO2 interface model is useful for studying semiconductorโ€“oxide boundaries, including interface stability and electronic behavior. It can help explore effects relevant to microelectronic and optoelectronic devices. Available online in our materials bank: platform.mat3ra.com/bank/matโ€ฆ" #mat3rials3xplorer #materialsscience #mat3ra
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โšก๏ธ ๐—ฅ๐—ฒ๐—น๐—ฒ๐—ฎ๐˜€๐—ฒ ๐Ÿฎ๐Ÿฌ๐Ÿฎ๐Ÿฒ.๐Ÿฑ.๐Ÿฎ๐Ÿด ๐—ต๐—ถ๐—ด๐—ต๐—น๐—ถ๐—ด๐—ต๐˜๐˜€ - ๐—ฃ๐˜†๐˜๐—ต๐—ผ๐—ป-๐—ฏ๐—ฎ๐˜€๐—ฒ๐—ฑ ๐— ๐—Ÿ๐—™๐—™๐˜€, ๐— ๐—ฎ๐˜๐˜๐—ฒ๐—ฟ๐—ฆ๐—ถ๐—บ, ๐—š๐—ฃ๐—จ ๐˜€๐˜‚๐—ฝ๐—ฝ๐—ผ๐—ฟ๐˜ ๐—›๐—ผ๐˜„ ๐˜๐—ผ ๐— ๐—ฎ๐—ธ๐—ฒ ๐— ๐—ฎ๐—ฐ๐—ต๐—ถ๐—ป๐—ฒ-๐—Ÿ๐—ฒ๐—ฎ๐—ฟ๐—ป๐—ฒ๐—ฑ ๐—™๐—ผ๐—ฟ๐—ฐ๐—ฒ๐—ณ๐—ถ๐—ฒ๐—น๐—ฑ๐˜€ ๐—ฃ๐—ฟ๐—ฎ๐—ฐ๐˜๐—ถ๐—ฐ๐—ฎ๐—น ๐—ถ๐—ป ๐—ฅ๐—ฒ๐˜€๐—ฒ๐—ฎ๐—ฟ๐—ฐ๐—ต ๐—ช๐—ผ๐—ฟ๐—ธ๐—ณ๐—น๐—ผ๐˜„๐˜€: ๐— ๐—ฎ๐˜๐˜๐—ฒ๐—ฟ๐—ฆ๐—ถ๐—บ ๐—š๐—ฃ๐—จ ๐—ฆ๐˜‚๐—ฝ๐—ฝ๐—ผ๐—ฟ๐˜ Machine-learned forcefields are becoming increasingly useful in computational materials research, especially in the early stages of structure preparation and screening. But in practice, their value depends less on raw speed and more on whether they fit naturally into real scientific workflows. One of the most interesting updates in the recent platform release is a new step-by-step tutorial for using Python-based MLFF workflows to perform structural relaxation, phonon calculations, and similar tasks. The featured implementation is Microsoftโ€™s MatterSim, with NVIDIA GPUs used for acceleration. This matters because MLFFs are starting to play a meaningful role in pre-relaxing initial structures, screening larger candidate sets before higher-accuracy calculations, reducing the cost of DFT-heavy workflows, and connecting faster approximations with more rigorous downstream calculations. The key question is not whether MLFFs are fast enough. It is where they fit best in a research pipeline, and how to switch from approximate models to higher-fidelity methods without breaking reproducibility. That is why tutorial-driven workflows are valuable: they turn MLFFs from an abstract capability into something researchers can evaluate, reproduce, and adapt for actual work. Release page: mat3ra.com/news-and-blog-posโ€ฆ Per the video tutorial below: buff.ly/KDDE6X0 Also available at buff.ly/iWVAkFi. ๐Ÿ‘‰ Try it for free at buff.ly/C6bQY0M #materials #RnD #mat3ra #exabyteio #materialsscience #materialsdesign #materialsmodeling #science #technology
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๐Ÿ“… ๐—จ๐—ฝ๐—ฐ๐—ผ๐—บ๐—ถ๐—ป๐—ด ๐—˜๐˜ƒ๐—ฒ๐—ป๐˜๐˜€ June brings two opportunities to connect with the Mat3ra community โ€” one in Lafayette and one online. ๐—๐˜‚๐—ป๐—ฒ ๐Ÿณ โ€” ๐—”.๐—œ. ๐Ÿฎ ๐—ฆ๐—ฐ๐—ถ๐—ฒ๐—ป๐—ฐ๐—ฒ ๐—›๐—ฎ๐—ฝ๐—ฝ๐˜† ๐—›๐—ผ๐˜‚๐—ฟ | ๐—Ÿ๐—ฎ๐—ณ๐—ฎ๐˜†๐—ฒ๐˜๐˜๐—ฒ, ๐—–๐—” Join us for a casual meetup for people interested in the intersection of AI and science โ€” from materials science and chemistry to biology and beyond. Meet researchers, builders, students, entrepreneurs, and curious minds for thoughtful conversation in a relaxed local setting. ๐Ÿ”— mat3ra.com/events-posts/ai-2โ€ฆ ๐—๐˜‚๐—ป๐—ฒ ๐Ÿฎ๐Ÿฐ โ€” ๐— ๐—ฎ๐˜๐Ÿฏ๐—ฟ๐—ฎ ๐Ÿฎ๐——, ๐—ฆ๐—ฒ๐—ฎ๐˜€๐—ผ๐—ป ๐Ÿฎ, ๐—˜๐—ฝ๐—ถ๐˜€๐—ผ๐—ฑ๐—ฒ ๐Ÿฏ | ๐—ช๐—ฒ๐—ฏ๐—ถ๐—ป๐—ฎ๐—ฟ Learn how to compute electronic properties of 2D materials โ€” including band gap, band structure, and density of states (DOS) โ€” with Quantum ESPRESSO from JupyterLab notebooks on the Mat3ra platform. ๐Ÿ”— mat3ra.com/events-posts/mat3โ€ฆ Join us in Lafayette or online. #Mat3ra #MaterialsScience #ComputationalMaterials #ScientificComputing #HPC #CloudComputing #DFT #2DMaterials
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๐Ÿ› ๏ธ ๐—ฃ๐—Ÿ๐—”๐—ง๐—™๐—ข๐—ฅ๐—  ๐—ฅ๐—˜๐—Ÿ๐—˜๐—”๐—ฆ๐—˜ โ€” ๐Ÿฎ๐Ÿฌ๐Ÿฎ๐Ÿฒ.๐Ÿฑ.๐Ÿฎ๐Ÿด ๐—ฅ๐—ฒ๐—น๐—ฒ๐—ฎ๐˜€๐—ฒ ๐Ÿฎ๐Ÿฌ๐Ÿฎ๐Ÿฒ.๐Ÿฑ.๐Ÿฎ๐Ÿด introduces several ๐—ป๐—ฒ๐˜„ ๐—ณ๐—ฒ๐—ฎ๐˜๐˜‚๐—ฟ๐—ฒ๐˜€ for practical simulation workflows. ๐—ž๐—˜๐—ฌ ๐—›๐—œ๐—š๐—›๐—Ÿ๐—œ๐—š๐—›๐—ง๐—ฆ โ€ข ๐— ๐—Ÿ๐—™๐—™ ๐˜๐˜‚๐˜๐—ผ๐—ฟ๐—ถ๐—ฎ๐—น ๐—ผ๐—ป ๐˜๐—ต๐—ฒ ๐—ฝ๐—น๐—ฎ๐˜๐—ณ๐—ผ๐—ฟ๐—บ A new step-by-step tutorial shows how to use ๐—ฃ๐˜†๐˜๐—ต๐—ผ๐—ป-๐—ฏ๐—ฎ๐˜€๐—ฒ๐—ฑ ๐—บ๐—ฎ๐—ฐ๐—ต๐—ถ๐—ป๐—ฒ-๐—น๐—ฒ๐—ฎ๐—ฟ๐—ป๐—ฒ๐—ฑ ๐—ณ๐—ผ๐—ฟ๐—ฐ๐—ฒ๐—ณ๐—ถ๐—ฒ๐—น๐—ฑ๐˜€ for structural relaxation, phonon calculations, and related workflows โ€” with ๐— ๐—ถ๐—ฐ๐—ฟ๐—ผ๐˜€๐—ผ๐—ณ๐˜โ€™๐˜€ ๐— ๐—ฎ๐˜๐˜๐—ฒ๐—ฟ๐—ฆ๐—ถ๐—บ as a featured implementation and ๐—ก๐—ฉ๐—œ๐——๐—œ๐—” ๐—š๐—ฃ๐—จ๐˜€ as an accelerator. โ€ข ๐— ๐—”๐—–๐—˜ ๐—ถ๐—ป ๐—๐˜‚๐—ฝ๐˜†๐˜๐—ฒ๐—ฟ / ๐—๐˜‚๐—ฝ๐˜†๐˜๐—ฒ๐—ฟ๐—Ÿ๐—ถ๐˜๐—ฒ A new notebook demonstrates how to use the ๐— ๐—”๐—–๐—˜ universal forcefield for structural pre-relaxation directly in a web browser, with no additional infrastructure required. โ€ข ๐—ก๐—ฒ๐˜„ ๐—ป๐—ผ๐˜๐—ฒ๐—ฏ๐—ผ๐—ผ๐—ธ๐˜€ ๐—ณ๐—ผ๐—ฟ ๐—บ๐—ฎ๐˜๐—ฒ๐—ฟ๐—ถ๐—ฎ๐—น๐˜€ ๐—ฐ๐—ฎ๐—น๐—ฐ๐˜‚๐—น๐—ฎ๐˜๐—ถ๐—ผ๐—ป๐˜€ New Jupyter notebooks have been added for: ๐—ฆ๐˜‚๐—ฟ๐—ณ๐—ฎ๐—ฐ๐—ฒ ๐—˜๐—ป๐—ฒ๐—ฟ๐—ด๐˜† ๐—˜๐—พ๐˜‚๐—ฎ๐˜๐—ถ๐—ผ๐—ป ๐—ผ๐—ณ ๐—ฆ๐˜๐—ฎ๐˜๐—ฒ ๐—™๐—˜๐—”๐—ง๐—จ๐—ฅ๐—˜๐—ฆ โ€ข Platform tutorial: Python-based MLFF workflows with MatterSim, including GPU acceleration โ€ข Jupyter / JupyterLite: MACE for structure pre-relaxation โ€ข Jupyter notebook for Surface Energy โ€ข Jupyter notebook for Equation of State โ€ข Webinar, Mat3ra-2D Season 2 Episode 2: Relaxation with MLFF DFT ๐—œ๐— ๐—ฃ๐—ฅ๐—ข๐—ฉ๐—˜๐— ๐—˜๐—ก๐—ง๐—ฆ โ€ข Surface Energy workflow updated to reuse build metadata from mat3ra-made ๐—™๐—œ๐—ซ๐—˜๐—ฆ โ€ข Fixed CLI jobs not registering in the web interface โ€ข Fixed reuse of identical Python virtualenvs โ€ข Fixed saving Combinatorial Set materials in MD/WA ๐—™๐—ข๐—ฅ ๐——๐—˜๐—ฉ๐—˜๐—Ÿ๐—ข๐—ฃ๐—˜๐—ฅ๐—ฆ โ€ข Mat3ra-2D manuscript: buff.ly/inR3GjJ โ€ข Update publish name for buff.ly/nZ2F7qJ to ๐—บ๐—ฎ๐˜๐Ÿฏ๐—ฟ๐—ฎ-๐—ป๐—ผ๐˜๐—ฒ๐—ฏ๐—ผ๐—ผ๐—ธ๐˜€-๐˜‚๐˜๐—ถ๐—น๐˜€ More on the highlights in the next additional posts on this topic! ๐Ÿ”œ ๐Ÿ‘‰ Try it for free at buff.ly/C6bQY0M ๐–ถ๐—๐–บ๐— ๐–ฝ๐—ˆ ๐—’๐—ˆ๐—Ž ๐—๐—๐—‚๐—‡๐—„ ๐—ˆ๐–ฟ ๐—๐—๐–พ๐—Œ๐–พ ๐–ผ๐—๐–บ๐—‡๐—€๐–พ๐—Œ? ๐–ฒ๐—๐–บ๐—‹๐–พ ๐—’๐—ˆ๐—Ž๐—‹ ๐—๐—๐—ˆ๐—Ž๐—€๐—๐—๐—Œ ๐—๐—‚๐—๐— ๐—Ž๐—Œ ๐–ป๐–พ๐—…๐—ˆ๐—.๐Ÿ‘‡ #materials #RnD #mat3ra #exabyteio #materialsscience #materialsdesign #materialsmodeling #science #technology
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โš›๏ธ Mat3rials 3xplorer. ๐—ญ๐—ถ๐—ป๐—ฐ ๐—ข๐˜…๐—ถ๐—ฑ๐—ฒ ๐˜„๐—ถ๐˜๐—ต ๐—Ÿ๐—ถ๐˜๐—ต๐—ถ๐˜‚๐—บ ๐—ถ๐—ป๐˜๐—ฒ๐—ฟ๐˜€๐˜๐—ถ๐˜๐—ถ๐—ฎ๐—น๐˜€ (๐—ญ๐—ป๐—ข(๐—Ÿ๐—ถ_๐—ถ)), ๐Ÿฎ๐˜…๐Ÿฎ๐˜…๐Ÿฎ ๐˜‚๐—ป๐—ถ๐˜ ๐—ฐ๐—ฒ๐—น๐—น. Available online in our materials bank: platform.mat3ra.com/bank/matโ€ฆ #mat3rials3xplorer #materialsscience #mat3ra
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โšกNewsletter 2026/05. Platform Release and News! - mailchi.mp/2cbc765fdd3c/joinโ€ฆ

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๐Ÿ˜… ๐— ๐—ฎ๐˜๐—ฒ๐—ฟ๐—ถ๐—ฎ๐—น๐˜€ ๐— ๐—ฒ๐—บ๐—ฒ ๐—ผ๐—ณ ๐˜๐—ต๐—ฒ ๐—ช๐—ฒ๐—ฒ๐—ธ! #materials #mat3ra #materialsscience #science #meme #sciencehumor #engineeringhumor #stemhumor #researchlife #mechanicalengineering
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โšกNewsletter 2026/05. Platform Release and News! - mailchi.mp/b3c290a8d118/joinโ€ฆ

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๐Ÿ’Ž ๐— ๐—ฎ๐˜๐—ฒ๐—ฟ๐—ถ๐—ฎ๐—น ๐—ผ๐—ณ ๐˜๐—ต๐—ฒ ๐— ๐—ผ๐—ป๐˜๐—ต ๐—œ๐—ป๐˜๐—ฒ๐—ฟ๐—ณ๐—ฎ๐—ฐ๐—ฒ ๐—ฏ๐—ฒ๐˜๐˜„๐—ฒ๐—ฒ๐—ป ๐—บ๐—ฒ๐˜๐—ฎ๐—น๐—น๐—ถ๐—ฐ ๐—Ÿ๐—ถ๐˜๐—ต๐—ถ๐˜‚๐—บ ๐—ฎ๐—ป๐—ฑ ๐—Ÿ๐—ถ๐˜๐—ต๐—ถ๐˜‚๐—บ ๐—ข๐˜…๐˜†๐—ฐ๐—ต๐—น๐—ผ๐—ฟ๐—ถ๐—ฑ๐—ฒ (๐—Ÿ๐—ถ(๐Ÿฌ๐Ÿฌ๐Ÿญ)/๐—Ÿ๐—ถ๐Ÿฏ๐—–๐—น๐—ข(๐Ÿฌ๐Ÿฌ๐Ÿญ)), ๐˜€๐˜๐—ฟ๐—ฎ๐—ถ๐—ป-๐—บ๐—ฎ๐˜๐—ฐ๐—ต๐—ถ๐—ป๐—ด ๐˜€๐˜‚๐—ฝ๐—ฒ๐—ฟ๐—ฐ๐—ฒ๐—น๐—น This strain-matched interface model combines metallic lithium with lithium oxychloride (Li3ClO), a promising antiperovskite solid electrolyte for next-generation solid-state batteries. It is designed to help study how lithium metal interacts with solid electrolytes at the atomic level, including interfacial stability, charge distribution, and ion transport. By capturing the contact between a reactive lithium anode and a solid electrolyte framework, this system provides useful insight into the design of more stable electrodeโ€“electrolyte interfaces for future energy storage technologies. ๐—”๐˜ƒ๐—ฎ๐—ถ๐—น๐—ฎ๐—ฏ๐—น๐—ฒ ๐—ถ๐—ป ๐˜๐—ต๐—ฒ ๐— ๐—ฎ๐˜๐Ÿฏ๐—ฟ๐—ฎ ๐—ฝ๐—น๐—ฎ๐˜๐—ณ๐—ผ๐—ฟ๐—บ ๐—ถ๐—ป: platform-new.mat3ra.com/bankโ€ฆ #MaterialOfTheMonth #Mat3ra #MaterialsScience #SolidStateBatteries #BatteryMaterials #Electrolytes #Interfaces #ComputationalMaterials
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๐Ÿš€ ๐—๐—ผ๐—ฏ ๐—ฃ๐—ผ๐˜€๐˜๐—ถ๐—ป๐—ด๐˜€! Weโ€™re hiring for two roles at Mat3ra. Open positions: ๐—ต๐˜๐˜๐—ฝ๐˜€://๐—บ๐—ฎ๐˜๐Ÿฏ๐—ฟ๐—ฎ.๐˜„๐—ผ๐—ฟ๐—ธ๐—ฎ๐—ฏ๐—น๐—ฒ.๐—ฐ๐—ผ๐—บ/ โ˜€๏ธ ๐—–๐—ผ๐—บ๐—ฝ๐˜‚๐˜๐—ฎ๐˜๐—ถ๐—ผ๐—ป๐—ฎ๐—น ๐— ๐—ฎ๐˜๐—ฒ๐—ฟ๐—ถ๐—ฎ๐—น๐˜€ ๐—ฆ๐—ฐ๐—ถ๐—ฒ๐—ป๐˜๐—ถ๐˜€๐˜ For scientists excited about working at the intersection of ๐—บ๐—ฎ๐˜๐—ฒ๐—ฟ๐—ถ๐—ฎ๐—น๐˜€ / ๐—ฐ๐—ต๐—ฒ๐—บ๐—ถ๐˜€๐˜๐—ฟ๐˜†, ๐—ฑ๐—ฎ๐˜๐—ฎ ๐˜€๐—ฐ๐—ถ๐—ฒ๐—ป๐—ฐ๐—ฒ, and ๐—ฐ๐—ผ๐—บ๐—ฝ๐˜‚๐˜๐—ฒ๐—ฟ ๐˜€๐—ฐ๐—ถ๐—ฒ๐—ป๐—ฐ๐—ฒ. The work includes: โ€ข nanoscale modeling across large sets of materials, surfaces, and reaction pathways โ€ข organizing simulation and experimental validation data โ€ข developing AI approaches on top of those datasets ๐Ÿง‘โ€๐Ÿคโ€๐Ÿง‘ ๐—–๐—ผ๐—บ๐—บ๐˜‚๐—ป๐—ถ๐˜๐˜† ๐—˜๐˜ƒ๐—ฎ๐—ป๐—ด๐—ฒ๐—น๐—ถ๐˜€๐˜ For outgoing scientists and engineers who want to combine strong technical background with community building. The work includes: โ€ข identifying strategic pathways for community growth โ€ข preparing case studies and technical presentations โ€ข delivering content and measuring KPI Letโ€™s make ๐—œ๐—ฟ๐—ผ๐—ป ๐— ๐—ฎ๐—ปโ€™๐˜€ ๐——๐—ถ๐—ด๐—ถ๐˜๐—ฎ๐—น ๐— ๐—ฎ๐˜๐—ฒ๐—ฟ๐—ถ๐—ฎ๐—น๐˜€ ๐—ฅ&๐—— experience a reality together. ๐Ÿ”— Apply here: ๐—ต๐˜๐˜๐—ฝ๐˜€://๐—บ๐—ฎ๐˜๐Ÿฏ๐—ฟ๐—ฎ.๐˜„๐—ผ๐—ฟ๐—ธ๐—ฎ๐—ฏ๐—น๐—ฒ.๐—ฐ๐—ผ๐—บ/ #Mat3ra #Hiring #JobOpenings #MaterialsScience #ComputationalMaterials #DataScience #AIforScience #CommunityBuilding
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โš›๏ธ Mat3rials 3xplorer. ๐—œ๐—ป๐˜๐—ฒ๐—ฟ๐—ณ๐—ฎ๐—ฐ๐—ฒ ๐—ฏ๐—ฒ๐˜๐˜„๐—ฒ๐—ฒ๐—ป ๐— ๐—ผ๐—น๐˜†๐—ฏ๐—ฑ๐—ฒ๐—ป๐˜‚๐—บ ๐—ง๐—ฟ๐—ถ๐—ผ๐˜…๐—ถ๐—ฑ๐—ฒ ๐—ฎ๐—ป๐—ฑ ๐—š๐—ฎ๐—น๐—น๐—ถ๐˜‚๐—บ ๐—”๐—ฟ๐˜€๐—ฒ๐—ป๐—ถ๐—ฑ๐—ฒ (๐— ๐—ผ๐—ข๐Ÿฏ(๐Ÿฌ๐Ÿญ๐Ÿฌ)/๐—š๐—ฎ๐—”๐˜€(๐Ÿฌ๐Ÿฌ๐Ÿญ)), ๐˜€๐˜๐—ฟ๐—ฎ๐—ถ๐—ป-๐—บ๐—ฎ๐˜๐—ฐ๐—ต๐—ถ๐—ป๐—ด ๐˜€๐˜‚๐—ฝ๐—ฒ๐—ฟ๐—ฐ๐—ฒ๐—น๐—น. Available online in our materials bank: platform.mat3ra.com/bank/matโ€ฆ #mat3rials3xplorer #materialsscience #mat3ra
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๐Ÿ“š ๐—ฅ๐—ฒ๐˜€๐—ฒ๐—ฎ๐—ฟ๐—ฐ๐—ต ๐—ฃ๐—ฎ๐—ฝ๐—ฒ๐—ฟ๐˜€ ๐˜„๐—ฒ ๐—น๐—ผ๐˜ƒ๐—ฒ ๐—ง๐—ผ๐˜„๐—ฎ๐—ฟ๐—ฑ๐˜€ ๐˜๐—ต๐—ฒ ๐—ฑ๐—ถ๐˜€๐—ฐ๐—ผ๐˜ƒ๐—ฒ๐—ฟ๐˜† ๐—ผ๐—ณ ๐—ต๐—ถ๐—ด๐—ต ๐—ฐ๐—ฟ๐—ถ๐˜๐—ถ๐—ฐ๐—ฎ๐—น ๐—บ๐—ฎ๐—ด๐—ป๐—ฒ๐˜๐—ถ๐—ฐ ๐—ณ๐—ถ๐—ฒ๐—น๐—ฑ ๐˜€๐˜‚๐—ฝ๐—ฒ๐—ฟ๐—ฐ๐—ผ๐—ป๐—ฑ๐˜‚๐—ฐ๐˜๐—ผ๐—ฟ๐˜€ This paper proposes a new route for superconductor discovery by focusing not only on critical temperature, but also on the often-overlooked role of the critical magnetic field. The authors present a computational database covering more than 7,300 electron-phonon superconductors and combine DFT-derived electronic structure with Eliashberg theory to predict key superconducting properties. The work points toward a more realistic framework for AI-driven inverse design of superconductors with both high (T_c) and high critical fields. ๐Ÿ”— Source: arxiv.org/abs/2601.21044 ๐Ÿ“„ PDF: arxiv.org/pdf/2601.21044 ๐—Ÿ๐—ฎ๐—ฟ๐—ด๐—ฒ-๐—ฆ๐—ฐ๐—ฎ๐—น๐—ฒ ๐—œ๐—ป๐˜๐—ฒ๐—ด๐—ฟ๐—ฎ๐˜๐—ถ๐—ผ๐—ป ๐—ผ๐—ณ ๐—˜๐˜…๐—ฝ๐—ฒ๐—ฟ๐—ถ๐—บ๐—ฒ๐—ป๐˜๐—ฎ๐—น ๐—ฎ๐—ป๐—ฑ ๐—–๐—ผ๐—บ๐—ฝ๐˜‚๐˜๐—ฎ๐˜๐—ถ๐—ผ๐—ป๐—ฎ๐—น ๐——๐—ฎ๐˜๐—ฎ ๐—ณ๐—ผ๐—ฟ ๐Ÿฎ๐—— ๐— ๐—ฎ๐˜๐—ฒ๐—ฟ๐—ถ๐—ฎ๐—น๐˜€ This paper introduces X2DB, an open infrastructure designed to connect fragmented experimental and computational knowledge on 2D materials. The authors identify 370 experimentally realized 2D materials and link them to computational counterparts, enabling more consistent analysis across monolayer, bilayer, and bulk forms. For the materials community, the work is especially interesting as a foundation for data-driven, predictive synthesis and tighter integration between experimental results and ab initio modeling. ๐Ÿ”— Source: pubs.acs.org/doi/10.1021/acsโ€ฆ ๐Ÿ“„ Preprint/PDF: arxiv.org/pdf/2603.05083 #ResearchPapers #MaterialsScience #ComputationalMaterials #Superconductors #2DMaterials #AIforScience #DFT #Materials
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๐Ÿ“ฐ ๐—œ๐—ป๐—ฑ๐˜‚๐˜€๐˜๐—ฟ๐˜† ๐—ก๐—ฒ๐˜„๐˜€ ๐—ก๐—ฉ๐—œ๐——๐—œ๐—” ๐—ฎ๐—ป๐—ฑ ๐—š๐—ผ๐—ผ๐—ด๐—น๐—ฒ ๐—–๐—น๐—ผ๐˜‚๐—ฑ ๐˜๐—ฎ๐—ฟ๐—ด๐—ฒ๐˜ ๐—ฝ๐—ต๐˜†๐˜€๐—ถ๐—ฐ๐—ฎ๐—น ๐—”๐—œ ๐—ณ๐—ฎ๐—ฐ๐˜๐—ผ๐—ฟ๐—ถ๐—ฒ๐˜€ NVIDIA and Google Cloud have expanded their partnership around what they call โ€œphysical AI factories,โ€ combining new GPU infrastructure, confidential computing, and updated enterprise AI tooling. For the engineering community, this is more than another cloud announcement: it reflects how AI infrastructure is evolving for industrial, simulation-heavy, and performance-critical workloads. The news also points to a broader shift toward secure, deployable, and scalable AI environments for next-generation systems. ๐Ÿ”— Source: eenewseurope.com/en/News/?utโ€ฆ ๐—œ๐—ค๐—  ๐—ฟ๐—ฎ๐—ถ๐˜€๐—ฒ๐˜€ โ‚ฌ๐Ÿฑ๐Ÿฌ๐—  ๐˜๐—ผ ๐—ฏ๐—ผ๐—ผ๐˜€๐˜ ๐—พ๐˜‚๐—ฎ๐—ป๐˜๐˜‚๐—บ ๐—ฐ๐—ผ๐—บ๐—ฝ๐˜‚๐˜๐—ถ๐—ป๐—ด ๐—ฟ๐—ผ๐—ฎ๐—ฑ๐—บ๐—ฎ๐—ฝ Finnish quantum computing company IQM has secured a โ‚ฌ50 million financing package from funds and accounts managed by BlackRock to accelerate R&D, support global expansion, and advance its quantum technology roadmap. The funding is expected to help strengthen IQMโ€™s superconducting quantum systems and scale development further. For the European deep-tech ecosystem, this is an important signal of growing investor confidence in quantum hardware and long-term quantum infrastructure. ๐Ÿ”— Source: eenewseurope.com/en/iqm-raisโ€ฆ #IndustryNews #Electronics #EdgeAI #QuantumComputing #Semiconductors #DeepTech #Engineering #AIInfrastructure
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โš›๏ธ Mat3rials 3xplorer. Gallium Phosphide with Sulfur substitutions (GaP(S_P)), 2x2x2 unit cell. Available online in our materials bank: platform.mat3ra.com/bank/matโ€ฆ #mat3rials3xplorer #materialsscience #mat3ra
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โšก๏ธ ๐—ฅ๐—ฒ๐—น๐—ฒ๐—ฎ๐˜€๐—ฒ ๐Ÿฎ๐Ÿฌ๐Ÿฎ๐Ÿฒ.๐Ÿฏ.๐Ÿฎ๐Ÿฒ ๐—ต๐—ถ๐—ด๐—ต๐—น๐—ถ๐—ด๐—ต๐˜๐˜€ - ๐—๐˜‚๐—ฝ๐˜†๐˜๐—ฒ๐—ฟ ๐—ป๐—ผ๐˜๐—ฒ๐—ฏ๐—ผ๐—ผ๐—ธ๐˜€ ๐—ณ๐—ผ๐—ฟ ๐—ฐ๐—ฎ๐—น๐—ฐ๐˜‚๐—น๐—ฎ๐˜๐—ถ๐—ผ๐—ป๐˜€. We started populating the api-example notebooks with example calculations. ๐Ÿ‘‰ Try it for free at mat3ra.com/?utm_source=twittโ€ฆ #materials #RnD #mat3ra #exabyteio #materialsscience #materialsdesign #materialsmodeling #science #technology
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๐Ÿ“ ๐—”.๐—œ. ๐Ÿฎ ๐—ฆ๐—ฐ๐—ถ๐—ฒ๐—ป๐—ฐ๐—ฒ ๐—›๐—ฎ๐—ฝ๐—ฝ๐˜† ๐—›๐—ผ๐˜‚๐—ฟ ๐—ถ๐—ป ๐—Ÿ๐—ฎ๐—ณ๐—ฎ๐˜†๐—ฒ๐˜๐˜๐—ฒ ๐—ผ๐—ป ๐— ๐—ฎ๐˜† ๐Ÿฏ On May 3, we hosted A.I. 2 Science Happy Hour in Lafayette, California โ€” a casual gathering for people interested in the intersection of AI and science. It was a great evening of conversations, new connections, and shared ideas across research, engineering, and innovation. ๐Ÿ“… Couldnโ€™t join? Hereโ€™s your chance: Join us at our next event โ€” ๐Ÿงช A.I. 2 Science Happy Hour ๐Ÿ“ June 7 | Lafayette, CA ๐Ÿ”— mat3ra.com/events-posts/ai-2โ€ฆ #AI #AIforScience #MaterialsScience #ScientificCommunity #Networking #Innovation #Mat3ra
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๐Ÿ—“๏ธ AI 2 Science Happy Hour, Mat3ra-2D Webinar, Tokyo Materials Cafe and more! - mailchi.mp/515a46ac8504/joinโ€ฆ

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โšก๏ธ ๐—ฅ๐—ฒ๐—น๐—ฒ๐—ฎ๐˜€๐—ฒ ๐Ÿฎ๐Ÿฌ๐Ÿฎ๐Ÿฒ.๐Ÿฏ.๐Ÿฎ๐Ÿฒ ๐—ต๐—ถ๐—ด๐—ต๐—น๐—ถ๐—ด๐—ต๐˜๐˜€ - ๐—ฃ๐˜‚๐—ฏ๐—น๐—ถ๐—ฐ ๐—›๐—ฃ๐—– ๐—ฐ๐—ผ๐—ป๐˜๐—ฎ๐—ถ๐—ป๐—ฒ๐—ฟ ๐—ฟ๐—ฒ๐—ด๐—ถ๐˜€๐˜๐—ฟ๐˜† New registry ready to receive pull requests from new additions at github.com/Exabyte-io/applicโ€ฆ ๐Ÿ‘‰ Try it for free at mat3ra.com/?utm_source=twittโ€ฆ #materials #RnD #mat3ra #exabyteio #materialsscience #materialsdesign #materialsmodeling #science #technology
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