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

Bach Lab | TUM@bach-lab.bsky.social · last yr.

Excited to share the news: Niklas' paper on enantiopure oxetanes is out now in @jacs.acspublications.org. Great work by all and big thanks to all collaboration partners! 💡👏 #photochemistry #enantioselectivity doi.org/10.1021/jacs...

Check out our pre-print on accelerated semi-empirical electronic structure theory calculations on consumer-grade GPUs! ⬇️

ChemRxiv Bot@chemrxivbot.bsky.social · last yr.

Acceleration of semi-empirical electronic structure theory calculations on consumer-grade GPUs using mixed precision density matrix purification Authors: Pit Steinbach, Christoph Bannwarth DOI: 10.26434/chemrxiv-2025-dqh6v

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