J. George
J. George
@kaueltzen could you maybe take a look?
@shyuep these failing tests seem to be "tests" that make sure the input sets stay the same. Some hashes are out of date. They say one should notify all input...
One more thing: i feel we again need to install LobsterPy with these changes. If you have time for this, @DanielYang59 , this would be highly appreciated. (Atomate2 will now...
> > i feel we again need to install LobsterPy with these changes. > > I assume you mean "test" `LobsterPy`? Exactly, I don't expect any change in functionality, but...
@DanielYang59 Great, I am fine if this gets merged now. We will see if atomate2 tests pass after merging.
It looks like a custodian error but I am not sure. There was this bug: https://github.com/materialsproject/custodian/issues/340
How does the timing look like? Does the database insertion completely finish during the process or is the time only enough to finish the vasp run but not the whole...
@utf @Zhuoying @janosh any ideas?
@edansi thank you for the update! Happy that you were able to figure it out!
@4kevinbeck5 oh, that's cool. Would love to make it available for Vasp once we have some time