Lifelong Machine Learning Potentials
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Marco Eckhoff and Markus Reiher (2023)
Highlighted by Jan Jensen
While machine learning potentials (MLPs) can give you DFT accuracy at FF
costs, they als...
3 weeks ago
8 comments:
Glad you like the new keyboard shortcuts, also note that using the arrow keys you can rotate the display, shift or control + arrows accesses translation/zoom too. I am sure we could figure out how to change the bond order for the next release too ;-)
The bond order feature is now implemented -- pretty easy to do, really. Thanks for the suggestion!
Marcus: yes, ctrl-arrow works for me. That's be great for fine-tuning the orientation. Btw, you are the first to comment on this blog. I owe you a beer next time we meet.
Geoff: Wow, that was fast. This blog has already payed off!
Good to see you on the blogosphere.
You're missing a subscribe link.
Noel: done!
I didn't realise I was the first commenter on your blog - I will definitely take you up on that beer next time we meet :-) I really enjoy the new blog, it is inspiring to see everything you are doing with Avogadro, along with introducing me to new things chemistry related. Thanks.
Marcus, It's a deal.
I find Avogadro inspiring, so it works both ways.
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