#AI4AM2025
MaX Coordinator Elisa Molinari (CNR-nano & UNIMORE) presenting MaX Centre of Excellence and its lighthouse codes (QuantumESPRESSO, YAMBO, BigDFT, SIESTA, FLEUR) for quantum materials simulations.

#HPC #AI

New blog post: Using Spack on top of EESSI: A Proof of Concept

Can we convince Spack to reuse software installations available in EESSI to resolve required dependencies when installing QuantumESPRESSO?

www.eessi.io/docs/blog/20...

@spackpm.bsky.social

Just posted a useful video on creating input files for
#QuantumESPRESSO
👇👇👇
www.youtube.com/watch?v=aKG1...

#CompChem

Funny thing:LLM generated API scripts DO have use when it comes to scientific computing packages (like Quantumespresso, Meep, FDTDX, Miepython, others), so the watermark is prolly an ok for folks, as it can point to a model that could have produced a working, real world application of the package.

End of an era. I used Piz Daint for the first time during my MSc in Physics at EPFL in 2015-2016 to study oxygen defects in InAlN semiconductors with QuantumESPRESSO. So sad I had to miss the shutdown ceremony. 🤒

📢 Hiring into three new roles in the OneDFT team at MSR AI for Science! 💼 ⬇️

Join our mission to make DFT accurate and reliable, learn more at aka.ms/dft

Soon, back to tackling one of my passions: solid state physics (hello again, Si surfaces and its reconstructions!). But first, a quick study on good ol' bulk Si to learn how to calculate its dielectric function with Yambo. #CompChemSky #CompSolidStatePhysics #Yambo #QuantumEspresso #DFT

• [1/3] Want to help us bringing the Skala functional into the materials world?—Senior Research Engineer in DFT for Materials Science careerhub.microsoft.com/careers/job/...

📅 𝗨𝗽𝗰𝗼𝗺𝗶𝗻𝗴 𝗠𝗮𝘁𝟯𝗿𝗮 𝗘𝘃𝗲𝗻𝘁𝘀 𝗶𝗻 𝗔𝘂𝗴𝘂𝘀𝘁

💻 𝗔𝘂𝗴𝘂𝘀𝘁 𝟮𝟲 — 𝗠𝗮𝘁𝟯𝗿𝗮 𝟮𝗗 𝗪𝗲𝗯𝗶𝗻𝗮𝗿, 𝗦𝗲𝗮𝘀𝗼𝗻 𝟮 𝗘𝗽𝗶𝘀𝗼𝗱𝗲 𝟱
buff.ly/kMfJCeX

#Mat3ra #MaterialsScience #Webinar #TokyoEvents #ComputationalMaterials #QuantumESPRESSO

Machiavelli was the first sigma CEO. Feared espresso means you dominate the boardroom! I'm totally plussed by his logic. We’ll burn that bridge when we drink it! Total paradigm shift. ☕️🔥 #SigmaBeans #GrindsetVibes #QuantumEspresso #DeepBrew

aiida-quantumespresso-test 4.0.0a1 (Production/Stable)

The official AiiDA plugin for Quantum ESPRESSO

Author: The AiiDA team
📖Documentation
🏠Home
🧑‍💻Source

aiida-quantumespresso 4.12.0 (Production/Stable)

The official AiiDA plugin for Quantum ESPRESSO

Author: The AiiDA team
📖Documentation
🏠Home
🧑‍💻Source