Closed LaTruelle closed 2 years ago
The version on the dev branch should be able to open these files: https://github.com/QChASM/SEQCROW/tree/dev
there's installation instructions if you scroll down to the readme. I'll make a few more changes before updating the toolshed version.
Indeed, it works, thanks! I still get the error about the Radii from AaronTools, but I can at least open the files and plot orbitals.
Feel free to ask me for further testing if required!
Describe the bug I cannot open a file containing a thorium atom.
To Reproduce Open any Gaussian calculation with Th in it
Expected behavior It should open!
Screenshots![image](https://user-images.githubusercontent.com/1679586/176883327-7a77f155-1cee-4e5c-9ceb-36f4fdbc79a1.png)
It seems to be AaronTools based.