On Wednesday afternoon at #ACSFall2021, Ryan Fortenberry will be talking about our Psi4Education program. It’s a hybrid session so you can join in-person or virtually!
Shiny new stickers and no #ACSPhilly to go to. Stay well and code, everyone.
PsiCon2019 attendees enjoying the wonderful Emory conference room in Atwood. GT, take note — chairs that hold, rather than eject, their occupants and are silent, rather then squawking to rival the speaker. Looking forward to PsiCon2020 at CCQC at UGA!
Rollin King reporting on Optking. Challenging optimization — can do. Figuring out who calls who to satisfy all use cases in a distributed ecosystem with multiple entry points — WIP.
Two approaches to improving dispersion in SAPT. -D for speed by Dom Sirianni with David Sherrill. F12 for accuracy by Monika Kodrycka with Konrad Patkowski.
@ARingerMcDonald presents connections to expand access to Psi4 beyond the development community at PsiCon2019.
More details on @MolSSI_NSF ‘s QCArchive project by @dga_smith at MLSE conference at GaTech.
Psi4Numpy backing machine learning by Jacob Townsend out of Vogiatzis group at MLSE conference at GaTech.
Thanks, @MolSSI_NSF and organizers @dga_smith, @jesacat for a great symposium at #ACSOrlando. Dip in Psi4 github activity this week to learn from and talk with CMS community. Today symp. finally got a room with walls — very appropriate room number.
A nice image from Lori Burns presented at #ACSOrlando about the growing Psi4 ecosystem. Great to be part of an ecosystem of over 60 modules in a variety of different programming languages!
#compchem
Free embarrassing parallelism and nifty interactive visualization coming soon to Psi4 thanks to the distributed driver and @MolSSI_NSF ‘s QCArchive qcarchive.molssi.org . Great talk by Levi Naden at #ACSOrlando
























