Earlier quoted context omitted.
Sure it’s post hoc, but these are ab initio calculations, there’s not all that much wiggle room that you could make anything you like come out looking like a superconductor. Plus now I’ve seen three calculations with three different functionals and reasonable convergence criteria and they all find similar electronic structure
Well, then why spend all this time searching in a lab? Instead, run a bunch of simulations until the compounds with properties you desire just sort of pop out as the top hits in your simulations? (I say this as somebody with a decade+ of experience running large ensembles of classical MD simulations, but not so much experience with inorganic DFT)
Edit: Also look at how long these (short pre-print) DFT articles are. These aren't simple calculations to interpret.