You signed in with another tab or window. Reload to refresh your session.You signed out in another tab or window. Reload to refresh your session.You switched accounts on another tab or window. Reload to refresh your session.Dismiss alert
I was trying to use the VASP drone in atomate2 to parse an SOC enabled calculation and face the pydantic validation error which says the magnetic moment should be a list. But I believe VASP outputs it as a 3D matrix. Now I am not sure if this is an reported issue but if so, is there a way to make it work?
reacted with thumbs up emoji reacted with thumbs down emoji reacted with laugh emoji reacted with hooray emoji reacted with confused emoji reacted with heart emoji reacted with rocket emoji reacted with eyes emoji
Uh oh!
There was an error while loading. Please reload this page.
-
Hi,
I was trying to use the VASP drone in atomate2 to parse an SOC enabled calculation and face the pydantic validation error which says the magnetic moment should be a list. But I believe VASP outputs it as a 3D matrix. Now I am not sure if this is an reported issue but if so, is there a way to make it work?
Thank you
Rushik
Beta Was this translation helpful? Give feedback.
All reactions