The details of changes in the 0.1.0-0.1.0 version is as follows:
- Adding the prototypes of the exchange-correlation (XC) functionals
- The implementation of the hard-coded Slater exchange and SVWN3 correlation functionals begins in functional.cc and functional.h source and header files.
- The mcpdft.h file hosts the declaration of some I/O utility functions.
- Adds the functional.cc file to the list of sources for the mcpdft executable in the CMakeLists.txt.
- Affected files (5):
- Download the source (version 0.1.0-0.1.0):