Skip to content
This repository has been archived by the owner on Sep 27, 2021. It is now read-only.

csg_inverse: allow overwriting of dU #91

Closed
GoogleCodeExporter opened this issue Aug 18, 2015 · 2 comments
Closed

csg_inverse: allow overwriting of dU #91

GoogleCodeExporter opened this issue Aug 18, 2015 · 2 comments

Comments

@GoogleCodeExporter
Copy link

We used this in http://dx.doi.org/10.1002/mats.201100011

Overwriting could take place at two points:
-at the end of post_update or at the end of post_add
-post_update make not much sense, one wants to have the same pot, but not the 
same update
-post_add always does shift and tag at the end so overwritten potential would 
not be shifted/tagged at all.
-possibly shift can be move to post_update and tag to the first post_add task

Original issue reported on code.google.com by christop...@gmail.com on 28 Apr 2011 at 12:59

@GoogleCodeExporter
Copy link
Author

> -possibly shift can be move to post_update and tag to the first post_add task
This has be done and tested. 

The attached postadd script has to be ported to VOTCA 1.2 style and that's it.

Original comment by christop...@gmail.com on 14 Jun 2011 at 10:46

  • Changed state: Started

Attachments:

@GoogleCodeExporter
Copy link
Author

This issue was closed by revision 3617edeffcad.

Original comment by christop...@gmail.com on 16 Jun 2011 at 1:37

  • Changed state: Fixed

Sign up for free to subscribe to this conversation on GitHub. Already have an account? Sign in.
Projects
None yet
Development

No branches or pull requests

1 participant