conquest/tools
David Bowler 39fff6ae08
Merge pull request #369 from OrderN/f-more-pseudo-info
More output on type of pseudopotential added
2024-10-18 14:17:09 +01:00
..
BasisGeneration Merge pull request #369 from OrderN/f-more-pseudo-info 2024-10-18 14:17:09 +01:00
PostProcessing Use one system.make file for all compilations 2024-09-18 11:07:21 +01:00
Conquest_ONCVPSP_output.patch Add overview of PAO generation procedure 2022-12-15 15:56:53 +09:00
README.md Initial import of charge conversion utility 2020-07-21 15:43:42 +01:00

README.md

Utilities for working with CONQUEST are located here.

  1. Basis generation code
  2. Process charge density (produce CUBE files from Conquest output)