This suite of tests does finite difference test of DFT response functions calculated by Dalton The following files are given::

submitall
gen_findif_all.py
common_findif.py
mol.py
findif.py
makefile
makehtml.py

A bash script which takes a functional name or file with list of functionals

submitall <functional_name|file_name>

In addition to given functionals a reference HF calculation will be done at all levels

contains templates for test cases to be executed with nosetests. Test files are generate by looping over all functional names provided in input

Contains data common to all tests and Used by gen_findif_all.py

A reference molecule used for all calculations

Performs all tests providing a rule for getting a logfile depening on a file with unit tests

Defines classes for performing response calculations

Collects resulting log files and presents results in a html format