DOKK / manpages / debian 12 / cclib / cclib-cda.1.en
CCLIB-CDA(1) User commands CCLIB-CDA(1)

cclib-cda - command-line interface for charge decomposition analysis with cclib

cclib-cda [file]

The command cclib-cda a simple command-line interface to cclib that invokes the charge decomposition analysis (CDA) for a given log file.

This manpage was written by Karol M. Langner <karol.langner@gmail.com> for the Debian distribution (but may be used by others).

2016-10-06