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Johann Brehmer

@johannbrehmer

Machine learner & physicist. At CuspAI, I teach machines to discover materials for carbon capture. Previously Qualcomm AI Research, NYU, Heidelberg U.

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19.10.2023
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Latest posts by Johann Brehmer @johannbrehmer

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Scaling Laws in Particle Physics Data! This is a result I've been itching to share and it's finally out. One of the big open questions is how much better AI-based methods at particle colliders can still become. 1/4

01.02.2026 11:55 πŸ‘ 16 πŸ” 7 πŸ’¬ 3 πŸ“Œ 0

Congrats Shubhendu!

09.01.2026 06:39 πŸ‘ 1 πŸ” 0 πŸ’¬ 1 πŸ“Œ 0
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Applied ML Researcher (Generative Models) Due to growth, we are seeking an experienced Applied ML Researcher (Generative Models)* to join our growing team and build SOTA generative models to design new materials at CuspAI.

We're looking for a few profiles:
1. generative models (come work with me!): jobs.ashbyhq.com/cuspai/b8108...
2. molecular simulation: jobs.ashbyhq.com/cuspai/3bb2f...
3. materials foundation models: jobs.ashbyhq.com/cuspai/90a8f...
4. semiconductors: jobs.ashbyhq.com/cuspai/f6a81...

2/2

01.01.2026 19:51 πŸ‘ 0 πŸ” 0 πŸ’¬ 0 πŸ“Œ 0

Happy New Year!

Do your plans for 2026 include...
- working with a great team lead by @wellingmax.bsky.social and @aronwalsh.github.io?
- living in Amsterdam, Berlin, London, or Cambridge?
- using fun tools from ML and material science?
- solving important problems?

Then join us at CuspAI!

1/2

01.01.2026 19:51 πŸ‘ 8 πŸ” 2 πŸ’¬ 1 πŸ“Œ 0
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Application Scientist (Semiconductor Modelling & Design) Due to growth, we are seeking an Application Scientist (Semiconductor Modelling & Design)* to strengthen our team in London on artificial intelligence for inorganic crystals, and to play a crucial par...

Or join our semiconductor team!

Still plenty of ML (especially generative models) in this role, but with a focus on semiconductor modelling and design.

jobs.ashbyhq.com/cuspai/f6a81...

Same great team, but working directly w/ Aron Walsh in London.

Happy to chat!

2/2

15.12.2025 08:52 πŸ‘ 2 πŸ” 0 πŸ’¬ 0 πŸ“Œ 0
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Applied ML Researcher (Generative Models) Due to growth, we are seeking an experienced Applied ML Researcher (Generative Models)* to join our growing team and build SOTA generative models to design new materials at CuspAI.

Come work with us at @cuspai.bsky.social in the generative model team!

Excited about flow / diffusion models and chemistry? Looking for impact?

jobs.ashbyhq.com/cuspai/b8108...

Join a great team lead by @wellingmax.bsky.social and Aron Walsh, work in Amsterdam / Cambridge / London / Berlin.

1/2

15.12.2025 08:52 πŸ‘ 5 πŸ” 3 πŸ’¬ 1 πŸ“Œ 1

Today at NeurIPS (SD), come meet the @cuspai.bsky.social team and learn about our work!

Find us at 5:30pm at booth 1343 (Renaissance Philanthropy / UK government)

02.12.2025 17:48 πŸ‘ 5 πŸ” 0 πŸ’¬ 1 πŸ“Œ 0

As we go into the Thanksgiving holiday, I wanted to express my thanks to my collaborators @johannbrehmer.bsky.social @glouppe.bsky.social, Juan Pavez, @smsharma.bsky.social. Recently, I was awarded the Pritzker Prize for AI in Science for work on SBI. That wouldn't have never happened without them.

26.11.2025 18:26 πŸ‘ 16 πŸ” 2 πŸ’¬ 0 πŸ“Œ 0

I'll be at NeurIPS next week – together with my @cuspai.bsky.social colleagues @jonkhler.argmin.xyz, @hannahopenshaw.bsky.social, Friso de Kruiff, and @wellingmax.bsky.social.

If you'd like to chat about ML for material discovery, generative models, or start-ups made in Europe, ping me!

25.11.2025 12:37 πŸ‘ 9 πŸ” 0 πŸ’¬ 0 πŸ“Œ 0
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The Open DAC 2025 Dataset for Sorbent Discovery in Direct Air Capture Identifying useful sorbent materials for direct air capture (DAC) from humid air remains a challenge. We present the Open DAC 2025 (ODAC25) dataset, a significant expansion and improvement upon ODAC23...

It was great to work on the ODAC25 paper with the Meta FAIR Chemistry and Georgia Tech. A leap forwards in modelling direct air carbon capture with metal organic frameworks, with much better data and larger models.

Paper: arxiv.org/abs/2508.03162
Data and models: huggingface.co/facebook/ODA...

07.08.2025 23:25 πŸ‘ 9 πŸ” 4 πŸ’¬ 1 πŸ“Œ 0
Neuralatex: A machine learning library written in pure LATEX Neuralatex: A machine learning library written in pure LATEX

Are you tired of context-switching between coding models in @pytorch.org and paper writing on @overleaf.com?

Well, I’ve got the fix for you, Neuralatex! An ML library written in pure Latex!

neuralatex.com

To appear in Sigbovik (subject to rigorous review process)

01.04.2025 11:23 πŸ‘ 84 πŸ” 18 πŸ’¬ 2 πŸ“Œ 12
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An unexpected surprise. The 2025 Breakthrough Prize in Fundamental Physics honors over 13,000 researchers whose labors have led to the precise description the Higgs mechanism, … breakthroughprize.org/News/91 @CERN

05.04.2025 23:24 πŸ‘ 60 πŸ” 17 πŸ’¬ 2 πŸ“Œ 2
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STAND UP FOR SCIENCE March 7, 2025. Washington DC and nationwide. Because science is for everyone.

On March 7th, we’re Standing Up for Scienceβ€”
and against political censorship, autocracy, and fascism.

Science stands at a crossroads. This is a wider fight for truth, for democracy, and for the future.

We hope you join us.

www.standupforscience2025.org

02.03.2025 13:07 πŸ‘ 146 πŸ” 65 πŸ’¬ 1 πŸ“Œ 3

πŸ“£ Hiring! I am looking for PhD/postdoc candidates to work on foundation models for science at @ULiege, with a special focus on weather and climate systems. 🌏 Three positions are open around deep learning, physics-informed FMs and inverse problems with FMs.

30.12.2024 12:21 πŸ‘ 78 πŸ” 34 πŸ’¬ 4 πŸ“Œ 4

Thanks a lot, Guillaume!

16.12.2024 17:28 πŸ‘ 11 πŸ” 0 πŸ’¬ 0 πŸ“Œ 0
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Excellent talk by @johannbrehmer.bsky.social
On β€œDoes equivariance matter at scale?” At NeurReps workshop
arxiv.org/abs/2410.23179
www.neurreps.org

14.12.2024 19:14 πŸ‘ 63 πŸ” 7 πŸ’¬ 1 πŸ“Œ 2

If you're in Vancouver and want to chat about these papers, material discovery, or anything else, come by the posters or ping me!

6/6

11.12.2024 05:15 πŸ‘ 3 πŸ” 0 πŸ’¬ 0 πŸ“Œ 0
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You might not be surprised to hear that equivariance improves data efficiency.

But did you expect equivariant models to also be more *compute*-efficient? Learning symmetries from data costs FLOPs!

arxiv.org/abs/2410.23179
With SΓΆnke Behrends, @pimdh.bsky.social, and @taco-cohen.bsky.social.

5/6

11.12.2024 05:15 πŸ‘ 6 πŸ” 0 πŸ’¬ 1 πŸ“Œ 1

On Saturday at 11:00 at the @neurreps.bsky.social workshop, I'll talk about our investigation into the relevance of equivariance at scale.

We studied empirically how equivariant and non-equivariant architectures scale as a function of training data, model size, and training steps.

4/6

11.12.2024 05:15 πŸ‘ 3 πŸ” 1 πŸ’¬ 1 πŸ“Œ 0
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Combining L-GATr with Riemannian flow matching, they also constructed the first Lorentz-equivariant generative model.

arxiv.org/abs/2405.14806

With @jonasspinner.bsky.social, Victor BresΓ³, @pimdh.bsky.social, Tilman Plehn, and Jesse Thaler.

3/6

11.12.2024 05:15 πŸ‘ 4 πŸ” 0 πŸ’¬ 1 πŸ“Œ 0
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On Thursday from 11:00 to 14:00, I'll be cheering on @jonasspinner.bsky.social and Victor BresΓ³ at poster 3911.

They built L-GATr 🐊: a transformer that's equivariant to the Lorentz symmetry of special relativity. It performs remarkably well across different tasks in high-energy physics.

2/6

11.12.2024 05:15 πŸ‘ 3 πŸ” 1 πŸ’¬ 1 πŸ“Œ 0

Just arrived in Vancouver for #NeurIPS.

I'm looking forward to meeting old and new friends, learning a thing or two, and presenting some recent work:

1/6

11.12.2024 05:15 πŸ‘ 19 πŸ” 2 πŸ’¬ 1 πŸ“Œ 0
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A common question nowadays: Which is better, diffusion or flow matching? πŸ€”

Our answer: They’re two sides of the same coin. We wrote a blog post to show how diffusion models and Gaussian flow matching are equivalent. That’s great: It means you can use them interchangeably.

02.12.2024 18:45 πŸ‘ 255 πŸ” 58 πŸ’¬ 6 πŸ“Œ 7
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sbi reloaded: a toolkit for simulation-based inference workflows Scientists and engineers use simulators to model empirically observed phenomena. However, tuning the parameters of a simulator to ensure its outputs match observed data presents a significant challeng...

The sbi package is growing into a community project 🌍 To reflect this and the many algorithms, neural nets, and diagnostics that have been added since its initial release, we have written a new software paper πŸ“ Check it out, and reach out if you want to get involved: arxiv.org/abs/2411.17337

27.11.2024 11:17 πŸ‘ 60 πŸ” 22 πŸ’¬ 1 πŸ“Œ 4
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GitHub - heidelberg-hepml/lorentz-gatr: Repository for <Lorentz-Equivariant Geometric Algebra Transformers for High-Energy Physics> (J. Spinner et al 2024) Repository for <Lorentz-Equivariant Geometric Algebra Transformers for High-Energy Physics> (J. Spinner et al 2024) - heidelberg-hepml/lorentz-gatr

Thrilled to announce that L-GATr is going to NeurIPS 2024! Plus, there is a new preprint with extended experiments and a more detailed explanation.

Code: github.com/heidelberg-h...
Physics paper: arxiv.org/abs/2411.00446
CS paper: arxiv.org/abs/2405.14806

1/7

25.11.2024 15:27 πŸ‘ 15 πŸ” 1 πŸ’¬ 1 πŸ“Œ 0
Screenshot of Google scholar

Screenshot of Google scholar

Milestone: our review paper β€œThe Frontier of Simulation-Based Inference” coauthored with @glouppe.bsky.social & @johannbrehmer.bsky.social hit 1000 citations. I’m very excited about the potential for these methods to transform science!
www.pnas.org/doi/10.1073/...

simulation-based-inference.org

22.11.2024 13:16 πŸ‘ 89 πŸ” 7 πŸ’¬ 2 πŸ“Œ 1
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The snow is gently falling outside the window, the models are training, what could be better? Two articles cool to read:

Does Equivariance matter at scale? (@johannbrehmer.bsky.social et al.) arxiv.org/abs/2410.23179
Denoising Diffusion Bridge Models (Linqi Zhou et al.) arxiv.org/pdf/2309.16948

21.11.2024 12:48 πŸ‘ 42 πŸ” 3 πŸ’¬ 0 πŸ“Œ 0

Would love to be on the list as well, thanks!

20.11.2024 20:14 πŸ‘ 1 πŸ” 0 πŸ’¬ 1 πŸ“Œ 0

Oops, sorry and thanks!

19.11.2024 09:12 πŸ‘ 1 πŸ” 0 πŸ’¬ 0 πŸ“Œ 0

It's been a while, but I still like SBI β€” can you add me, too?

19.11.2024 07:38 πŸ‘ 1 πŸ” 0 πŸ’¬ 1 πŸ“Œ 0