GPL research code of Matthew R. Hermes
- cd /path/to/mrh/lib
- mkdir build ; cd build
- cmake ..
- make
- Add /path/to/mrh to Python's search path somehow. Examples:
- "sys.path.append ('/path/to')" in Python script files
- "export PYTHONPATH=/path/to:$PYTHONPATH" in the shell
- "ln -s /path/to/mrh /path/to/python/site-packages/mrh" in the shell
- PySCF
- Python 3