1 Pull request opened by 1 person

• CEH gradients

  #1153 opened Jan 9, 2025

1 Issue closed by 1 person

• Does xtb-6.7.1 (win) have a limitation on the memory or atoms’ number?

  #1155 closed Jan 13, 2025

4 Issues opened by 4 people

• ddCOSMO not variational

  #1159 opened Jan 14, 2025

• Temperature range read incorrectly

  #1158 opened Jan 14, 2025

• Can't manually setup neighbor list for GFN-FF

  #1157 opened Jan 12, 2025

• Memory leaks from opening files

  #1154 opened Jan 9, 2025

2 Unresolved conversations

Sometimes conversations happen on old items that aren’t yet closed. Here is a list of all the Issues and Pull Requests with unresolved conversations.

• Spelling of furan

  #1147 commented on Jan 9, 2025 • 0 new comments

• Minimum Hopping does not work in xtb 6.7.0 and 6.7.1

  #1063 commented on Jan 11, 2025 • 0 new comments