OpenRDM
An open-source library for reduced-density matrix-based analysis and computation
Version 0.1.0

The details of changes in the 0.1.0 version is as follows:

  • Adding the prototype source code files
    • The MCPDFT energy implementation and header files
    • The MCPDFT solver class implementation and header files
  • Adds the data folder including all input data for test cases
  • Affected files (12):
  • Download the source (version 0.1.0):