Senior Researcher at Microsoft research AI for Science.
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Thanks for giving it a try, we look forward to seeing what you can discover with it!
This is what we discovered so far 🙃 (audio on)
Thanks for giving it a try, we look forward to seeing what you can discover with it!
This is what we discovered so far 🙃 (audio on)
I have checked and I get the following plot for the H-H dimer dissociation.
It seems to me that your plot has some kind of periodic boundary conditions every 1 Angstrom?
I have checked and I get the following plot for the H-H dimer dissociation.
It seems to me that your plot has some kind of periodic boundary conditions every 1 Angstrom?