GRRM is the first computer program based on the SHS(ADD) algorithm for an automated exploration of chemical reaction pathways by utilizing energies obtained from solutions of HΨ＝EΨ. GRRM copes with long standing fundamental problems in chemistry by automated exploration of chemical reaction pathways.
For information on GRRM visit https://iqce.jp/GRRM/index_e.shtml
CP2K uses the general program interface of GRRM17. In order for the two codes to communicate correctly you need a Python script that can be downloaded from: