The lecture is part of a series on modeling within nanoscience, and the hosting site, nanohub.org, has many other interesting things.
g-xTB: A General-Purpose Extended Tight-Binding Electronic Structure Method
For the Elements H to Lr (Z=1–103)
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Thomas Froitzheim, Marcel Müller, Andreas Hansen, and Stefan Grimme (2025)
Highlighted by Jan Jensen
This highlight is coming to you live from Oslo where ...
2 weeks ago
2 comments:
hi,
congratulations on your blog.
i'm a chemist researcher too.
If you could, make an example about intrinsic reaction coordinate in gamess.
thank you,
Lucas
Thank you!
Good idea. I'll see what I can do.
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