Ground state and activation energy estimation for chemistry would be really useful. I know chemists are looking specifically at nitrogen fixation as one useful example.
Or as another example, I'm currently at a conference listening to a PhD student's research on biomolecular structure prediction (for protein design).
Cool stuff and thanks for the link, I'll have to learn about it when I have a bit more time.
I've always heard Qalgs for chemistry compared to classical methods though. Why do you think chemists are using CCSD and similar methods rather than the FT-ICR mass spectroscopy?
Or as another example, I'm currently at a conference listening to a PhD student's research on biomolecular structure prediction (for protein design).