William

Geometry optimization crashes after x steps

13

**Describe the bug** During a geometry optimization, DFTB+ will crash at the end of one SCF convergence cycle after x amount of geometry steps. It tends to be around 10-20...

Stack smashing for linear molecules

5

**Describe the bug** When running the following command: ```bash xtb mol.mol --ohess ``` a crash will occur in the section "Thermodynamic Functions" with the following error: ```bash *** stack smashing...

Fail to compile example integration_opengl/

2

### Is there an existing issue for this? - [X] I have searched the existing issues. ### Is this issue related to iced? - [X] My hardware is compatible and...

- [x] I believe this to be a bug with LigParGen - [ ] This is a feature request ## Issue Information Software name & Version : Current online version...