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Bannwarth Lab

@bannwarthlab.bsky.social
202 followers 265 following 7 posts

Theoretical Chemistry Research Group @ RWTH Aachen University ipc.rwth-aachen.de/Bannwarth

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Bannwarth Lab @bannwarthlab.bsky.social · 12/05/2025
Highly enantiopure oxetanes via unprecedented catalytic photochemical method: In collaboration with @bach-lab.bsky.social and @hauer-lab.bsky.social, our PhD student Mike Pauls helped elucidate the reaction course by quantum chemical calculations! Thanks to all 👏 @jacs.acspublications.org
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Bannwarth Lab @bannwarthlab.bsky.social · 07/03/2025
Check out our pre-print on accelerated semi-empirical electronic structure theory calculations on consumer-grade GPUs! ⬇️
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Bannwarth Lab @bannwarthlab.bsky.social · 03/03/2025
Hello Bluesky! Here’s a look at what we the Bannwarth Lab has been up to so far: ☀️ Investigating photochemical processes with computational chemistry - efficient sampling of minimum energy crossing points (MECP): doi.org/10.1021/acs.... 🧵1/5
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