Daniel Smith
Daniel Smith
One item that may also help which is (slowly) coming is a time estimator. So you can see when you have requested 10M core hours vs 10k core hours. Quantum...
@NGC2023 Thank you for the report, fortunately we have moved to mkdocs which has removed these files. We are currently preparing for another release.
I think we discussed this at one point, but there is no issue with Psi4 initializing/finalizing a MPI object as long as its optional. Its probably best if Psi4 does...
Closing in favor of https://github.com/pytorch/pytorch/issues/127109.
`opt_einsum` isn't natively aware of broadcasting rules and likely gets a bit confused on the size of the dimension (`i_dim=32`). Likely the easiest way to solve this is with preprocessing...
This is helpful that there are multiple needs for a preprocessor. Could you provide a list of paths, especially edge cases, that we should consider for testing? The first preprocessor...
As commented in #246 as well, can you try manually adding a `py.typed` to an install and see if you have any issues with the typing? I haven't been able...
When you say "support" what are you thinking of here? The simplest thing we can do is not modify the optimization algorithms and then group the results into be "good"...
@juanjosegarciaripoll gentle ping here.
One caution is the optimal algorithm scales factorially, with 10 input arrays you are generally pushing the limits with 10's of seconds to minutes runtime. You will find similar results...