When testing the 02-dmet-hchain example, i find no convergence in function of a larger kmesh. I used the following basis sets and kmesh basis_list = ['3-21g'] kmesh_list = [[1,1,5],[1,1,7],[1,1,9],[1,1,11],[1,1,13]] <img width="1593" height="1184" alt="Image" src="https://github.com/user-attachments/assets/4b7b033c-41af-44c4-9cc9-689d3b4e477a" /> #
When testing the 02-dmet-hchain example, i find no convergence in function of a larger kmesh.
I used the following basis sets and kmesh
basis_list = ['3-21g']
kmesh_list = [[1,1,5],[1,1,7],[1,1,9],[1,1,11],[1,1,13]]