Skip to content
Snippets Groups Projects

Fix go restart

Merged Fix go restart
fix_go_restart into hotfix-8.2
Merged Micael Oliveira requested to merge fix_go_restart into hotfix-8.2

Description

The xyz coordinates read during a geometry optimization restart were not properly converted from Anstrom to atomic units.

News snippet

Fixed bug in the geometry optimization restart.

Checklist

  • I have checked that my code follows the Octopus coding standards
  • I have added tests for all the new features added in this request.

Merge request reports

Pipeline #27053348 failed

Stage: external

Pipeline failed for 805ea2c1 on fix_go_restart

Test coverage 59.16% (-11.84%) from 0 jobs

Merged by Micael OliveiraMicael Oliveira 6 years ago (Aug 3, 2018 7:59am UTC)

Loading

Pipeline #27103338 failed

Stage: external

Pipeline failed for 805ea2c1 on hotfix-8.2

Test coverage 59.18% (-11.84%) from 0 jobs

Activity

Filter activity
  • Approvals
  • Assignees & reviewers
  • Comments (from bots)
  • Comments (from users)
  • Commits & branches
  • Edits
  • Labels
  • Lock status
  • Mentions
  • Merge request status
  • Tracking
Please register or sign in to reply