Skip to content
Snippets Groups Projects

Increase default number of RMMDIIS iterations to 5

Merged Sebastian Ohlmann requested to merge change_rmmdiis_default into develop

Description

Tests for various systems have shown that number of iterations are generally smaller for 5 RMMDIIS iterations and also the total time is smaller (although each iteration is slightly more costly). This increases the memory needed by RMMDIIS, but should be still moderate enough.

News snippet

Increase default number of RMMDIIS iterations to 5

Checklist

Merge request reports

Loading
Loading

Activity

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