-
Notifications
You must be signed in to change notification settings - Fork 75
New issue
Have a question about this project? Sign up for a free GitHub account to open an issue and contact its maintainers and the community.
By clicking “Sign up for GitHub”, you agree to our terms of service and privacy statement. We’ll occasionally send you account related emails.
Already on GitHub? Sign in to your account
bug in PeriodicForce #35
Comments
Go ahead and submit a pull req. :) |
Michał Please reach out to myself or @jordangarside to be added to the developers branch. |
@mkrompiec We're working on dev branch on gitlab. Just shoot me an email with your email and I can add you (jordangarside@gmail.com) if you're interested. :) |
Sign up for free
to join this conversation on GitHub.
Already have an account?
Sign in to comment
file TensorMol/ForceModifiers/Periodic.py
line 400:
return etore, ftore
should be changed to:
if (DoForce):
return etore, ftore
else:
return etore
The text was updated successfully, but these errors were encountered: