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mat3ra.bsky.social
🔍 Case Study

📋 M3GNET vs Quantum ESPRESSO - Accuracy vs Time.

Read more here: buff.ly/3Xm3Yqa

Share your thoughts with us after reading 🧠👇

#materials #RnD #mat3ra #materialsscience #materialsdesign #materialsmodeling #science #technology
March 4, 2025 at 7:59 PM
mat3ra.bsky.social
Materials Meme of the week! 🔬

Heh... 👀

#materials #RnD #mat3ra #exabyteio #materialsscience #materialsdesign #materialsmodeling #science #technology
September 5, 2025 at 7:01 PM
mat3ra.bsky.social
Materials Meme of the week! 🔬

👹

#materials #RnD #mat3ra #exabyteio #materialsscience #materialsdesign #materialsmodeling #science #technology
October 10, 2025 at 7:03 PM
mat3ra.bsky.social
Materials Meme of the week! 🔬

Oops 🫢

#materials #RnD #mat3ra #exabyteio #materialsscience #materialsdesign #materialsmodeling #science #technology
March 14, 2025 at 6:59 PM
mat3ra.bsky.social
Materials Meme of the week! 🔬

Materials scientists in their true form 🤝 👀

#materials #RnD #mat3ra #exabyteio #materialsscience #materialsdesign #materialsmodeling #science #technology
February 7, 2025 at 7:59 PM
mat3ra.bsky.social
⚡️ 𝗥𝗲𝗹𝗲𝗮𝘀𝗲 𝟮𝟬𝟮𝟲.𝟯.𝟮𝟲 𝗵𝗶𝗴𝗵𝗹𝗶𝗴𝗵𝘁𝘀 - 𝗝𝘂𝗽𝘆𝘁𝗲𝗿 𝗻𝗼𝘁𝗲𝗯𝗼𝗼𝗸𝘀 𝗳𝗼𝗿 𝗰𝗮𝗹𝗰𝘂𝗹𝗮𝘁𝗶𝗼𝗻𝘀.

We started populating the api-example notebooks with example calculations.

👉 Try it for free at buff.ly/Dd6ORy5

#materials #RnD #mat3ra #exabyteio #materialsscience #materialsdesign #materialsmodeling #science #technology
May 15, 2026 at 7:04 PM
mat3ra.bsky.social
📝 Recent Platform Updates

Release 2025.1.23 contains updates and improvements.

More on the highlights in the next additional posts on this topic! 🔜

#materials #RnD #mat3ra #exabyteio #materialsscience #materialsdesign #materialsmodeling #science #technology
January 29, 2025 at 7:59 PM
mat3ra.bsky.social
Material of the Month.

Silicon Carbide Spherical Nanoparticle with (001) orientation, 693 atoms.

Available in the Mat3ra platform in: platform.mat3ra.com/bank/materia...

#materials #RnD #mat3ra #exabyteio #materialsscience #materialsdesign #materialsmodeling #science #technology
August 20, 2025 at 6:59 PM
mat3ra.bsky.social
Research papers we love 🔬

📄 Coupling quantum mechanical simulations and AI paves way for screening new superconductors.
👥 by Songshan Lake Materials Laboratory.

More: buff.ly/psaO9Mc

#mat3ra #materialsscience #materialsdesign #materialsmodeling #science #technology
March 26, 2025 at 6:59 PM
mat3ra.bsky.social
⚡️ 𝗥𝗲𝗹𝗲𝗮𝘀𝗲 𝟮𝟬𝟮𝟲.𝟱.𝟮𝟴 𝗵𝗶𝗴𝗵𝗹𝗶𝗴𝗵𝘁𝘀 - 𝗣𝘆𝘁𝗵𝗼𝗻-𝗯𝗮𝘀𝗲𝗱 𝗠𝗟𝗙𝗙𝘀, 𝗠𝗮𝘁𝘁𝗲𝗿𝗦𝗶𝗺, 𝗚𝗣𝗨 𝘀𝘂𝗽𝗽𝗼𝗿𝘁

Per the video tutorial below: buff.ly/KDDE6X0
Also available at buff.ly/iWVAkFi.

👉Try it for free at buff.ly/MK9vcY3

#materials #RnD #mat3ra #exabyteio #materialsscience #materialsdesign #materialsmodeling #science
June 5, 2026 at 7:02 PM
mat3ra.bsky.social
⚡️ Release 2025.11.27 highlights - Python codebase conversion started.

Python codebase for multiple mat3ra stack open-source packages.

👉 Try it for free at mat3ra.com?utm_source=b...

#materials #mat3ra #exabyteio #materialsscience #materialsdesign #materialsmodeling #science #technology
December 12, 2025 at 8:02 PM
mat3ra.bsky.social
⚡️ Release 2026.2.26 highlights - M-CODE - Materials Categorization.

M-CODE - Materials Categorization via Ontology, Dimensionality and Evolution.

👉 Try it for free at mat3ra.com?utm_source=b...

#materials #RnD #mat3ra #materialsscience #materialsdesign #materialsmodeling #science
March 6, 2026 at 8:01 PM
mat3ra.bsky.social
📄 M-CODE: Materials Categorization via Ontology, Dimensionality and Evolution.

Applications-focused categorization of target structures with compact M-CODE tags.

Read the full article: arxiv.org/pdf/2602.14384

#materials #RnD #mat3ra #materialsscience #materialsdesign #materialsmodeling
March 13, 2026 at 8:02 PM
mat3ra.bsky.social
⚡️ 𝗥𝗲𝗹𝗲𝗮𝘀𝗲 𝟮𝟬𝟮𝟲.𝟯.𝟮𝟲 𝗵𝗶𝗴𝗵𝗹𝗶𝗴𝗵𝘁𝘀 - 𝗣𝘂𝗯𝗹𝗶𝗰 𝗛𝗣𝗖 𝗰𝗼𝗻𝘁𝗮𝗶𝗻𝗲𝗿 𝗿𝗲𝗴𝗶𝘀𝘁𝗿𝘆

New registry ready to receive pull requests from new additions at github.com/Exabyte-io/a...

👉 Try it for free at buff.ly/Dd6ORy5

#materials #RnD #mat3ra #exabyteio #materialsscience #materialsmodeling #science #technology
May 13, 2026 at 7:03 PM
mat3ra.bsky.social
🔍 Case Study

📋 Study of High-Entropy Alloys Using M3GNET forcefield.

Read more here: www.mat3ra.com/case-studies...

Share your thoughts with us after reading 🧠👇

#materials #RnD #mat3ra #exabyteio #materialsscience #materialsdesign #materialsmodeling #science #technology
March 11, 2025 at 6:59 PM
ananthgr.bsky.social
Our work on modeling extended defects in MoS2 is now out in Small!

onlinelibrary.wiley.com/doi/10.1002/...

We show how size and chemical environment affect nanopore geometry in MoS2, changing pore shapes from irregular to triangular.

#2Dmaterials #Nanopores #MaterialsModeling #DefectEngineering
Size and Chemical Environment Control Nanopore Geometry in 2D MoS2: From Irregular to Triangular Defects
This work addresses a longstanding challenge of developing a predictive framework for defect topologies in 2D MoS2. By combining density functional theory calculations, kinetic Monte Carlo simulation...
onlinelibrary.wiley.com
July 1, 2025 at 3:26 PM
mat3ra.bsky.social
🧠 Connecting Theory and Experiment with Mat3ra.com @ Pacific Northwest National Lab, 2026-02-24

Watch now: www.youtube.com/watch?v=lhN7...

Visit www.pnnl.gov/autonomous-s... for more information.

#materials #RnD #mat3ra #exabyteio #materialsscience #materialsdesign #materialsmodeling
Connecting Theory and Experiment with Mat3ra.com @ Pacific Northwest National Lab, 2026-02-24
This is a video recording of Timur Bazhirov presenting about Connecting Theory and Experiment with Mat3ra.com at the Pacific Northwest National Laboratory's Autonomous Science series on 2026-02-24.…
www.youtube.com
March 26, 2026 at 7:01 PM
mat3ra.bsky.social
⚡️ 𝗥𝗲𝗹𝗲𝗮𝘀𝗲 𝟮𝟬𝟮𝟲.𝟱.𝟮𝟴 𝗵𝗶𝗴𝗵𝗹𝗶𝗴𝗵𝘁𝘀 - pre-relax structures with Multiple MLFFs

MACE, Nequip, Mattersim, UMA, ChgNet

👉 Try it for free at mat3ra.com?utm_source=b...

#materials #RnD #mat3ra #exabyteio #materialsscience #materialsdesign #materialsmodeling #science #technology
July 8, 2026 at 7:04 PM
mat3ra.bsky.social
⚡️ 𝗥𝗲𝗹𝗲𝗮𝘀𝗲 𝟮𝟬𝟮𝟲.𝟱.𝟮𝟴 𝗵𝗶𝗴𝗵𝗹𝗶𝗴𝗵𝘁𝘀 - 𝗔𝗱𝗱 (𝗮𝗻𝘆) 𝗡𝗲𝘄 𝟯𝗿𝗱-𝗽𝗮𝗿𝘁𝘆 𝗔𝗽𝗽𝗹𝗶𝗰𝗮𝘁𝗶𝗼𝗻𝘀 𝘁𝗼 𝗠𝗮𝘁𝟯𝗿𝗮

Available at docs.mat3ra.com/guide/tutori....

👉 Try it for free at mat3ra.com?utm_source=b...

#materials #RnD #mat3ra #exabyteio #materialsscience #materialsdesign #materialsmodeling #science #technology
July 3, 2026 at 7:03 PM
mat3ra.bsky.social
🛠️ 𝗣𝗟𝗔𝗧𝗙𝗢𝗥𝗠 𝗥𝗘𝗟𝗘𝗔𝗦𝗘 — 𝟮𝟬𝟮𝟲.𝟲.𝟮𝟱

New in 2026.6.25: a tutorial for 3rd-party app support, a browser notebook with multiple MLFFs for structural relaxation, and new workflows for formation energy calculations.

👉 Try it for free at buff.ly/H60yAaS

#Mat3ra #MaterialsScience #materialsmodeling
July 1, 2026 at 7:02 PM
mat3ra.bsky.social
⚡️ 𝗥𝗲𝗹𝗲𝗮𝘀𝗲 𝟮𝟬𝟮𝟲.𝟯.𝟮𝟲 𝗵𝗶𝗴𝗵𝗹𝗶𝗴𝗵𝘁𝘀 - 𝗛𝟰𝗗 𝗶𝗻𝘀𝘁𝗮𝗻𝗰𝗲𝘀 𝗼𝗻 𝗚𝗼𝗼𝗴𝗹𝗲 𝗖𝗹𝗼𝘂𝗱

Per the screenshot below.

👉 Try it for free at buff.ly/Dd6ORy5

#materials #RnD #mat3ra #exabyteio #materialsscience #materialsdesign #materialsmodeling #science #technology
May 8, 2026 at 7:02 PM
mat3ra.bsky.social
⚡️ 𝗥𝗲𝗹𝗲𝗮𝘀𝗲 𝟮𝟬𝟮𝟲.𝟯.𝟮𝟲 𝗵𝗶𝗴𝗵𝗹𝗶𝗴𝗵𝘁𝘀 - New Mat3ra-2D webinar episode

New Mat3ra 2D episode(s): www.youtube.com/watch?v=fyCq...

👉 Try it for free at mat3ra.com?utm_source=b...

#materials #RnD #mat3ra #exabyteio #materialsscience #materialsdesign #materialsmodeling #science #technology
April 15, 2026 at 7:03 PM
mat3ra.bsky.social
⚡️ 𝗥𝗲𝗹𝗲𝗮𝘀𝗲 𝟮𝟬𝟮𝟲.𝟯.𝟮𝟲 𝗵𝗶𝗴𝗵𝗹𝗶𝗴𝗵𝘁𝘀 - Jupyter notebooks for calculations.

We started populating the api-example notebooks with example calculations.

👉 Try it for free at mat3ra.com?utm_source=b...

#materials #RnD #mat3ra #exabyteio #materialsscience #materialsdesign #materialsmodeling #science
April 10, 2026 at 7:02 PM
mat3ra.bsky.social
⚡️ 𝗥𝗲𝗹𝗲𝗮𝘀𝗲 𝟮𝟬𝟮𝟲.𝟯.𝟮𝟲 𝗵𝗶𝗴𝗵𝗹𝗶𝗴𝗵𝘁𝘀 - 𝗛𝗢𝗠𝗢-𝗟𝗨𝗠𝗢 𝗲𝗻𝗲𝗿𝗴𝗶𝗲𝘀.

New property extractor for NWChem calculations:

👉 Try it for free at mat3ra.com?utm_source=b...

#materials #RnD #mat3ra #exabyteio #materialsscience #materialsdesign #materialsmodeling #science #technology
April 8, 2026 at 7:04 PM
mat3ra.bsky.social
⚡️ Release 2026.3.26 highlights - LAMMPS.

Per the screenshot below.

👉 Try it for free at mat3ra.com?utm_source=b...

#materials #RnD #mat3ra #exabyteio #materialsscience #materialsdesign #materialsmodeling #science #technology
April 3, 2026 at 7:03 PM