Daniel Hollas
@danielhollas.bsky.social
It is alive! A heroic effort led by Antonio and Basile, documenting the current best practices for non-adiabatic MD simulations. Give it a read!
The first article of volume 7 is out now!
Learn how to simulate molecular dynamics in electronic excited states, beyond the Born-Oppenheimer approximation, with this best practices article by Prlj et al on nonadiabatic dynamics! #compchem
doi.org/10.33011/liv...
Learn how to simulate molecular dynamics in electronic excited states, beyond the Born-Oppenheimer approximation, with this best practices article by Prlj et al on nonadiabatic dynamics! #compchem
doi.org/10.33011/liv...
January 29, 2026 at 11:21 PM
It is alive! A heroic effort led by Antonio and Basile, documenting the current best practices for non-adiabatic MD simulations. Give it a read!
Reposted by Daniel Hollas
TIL there was a Scottish National Antarctic Expedition and it produced this image
May 15, 2025 at 5:26 PM
TIL there was a Scottish National Antarctic Expedition and it produced this image