# H2O-NR
respect --scf   --inp=h2o-hf
respect --tddft --inp=h2o-hf

respect --scf   --inp=h2o-rij
respect --tddft --inp=h2o-rij

respect --scf   --inp=h2o-exact
respect --tddft --inp=h2o-exact

respect --tddft --start-data=h2o-hf    --inp=cvs
respect --tddft --start-data=h2o-rij   --inp=cvs
respect --tddft --start-data=h2o-exact --inp=cvs

util/EAS_from_TDDFT.py --files=h2o-hf     --states='1-3' --damping=0.001  --window='0-20'    --points=500 --test > EAS-h2o-hf
generic_test EAS-h2o-hf

util/EAS_from_TDDFT.py --files=h2o-hf-cvs --states='1-4' --damping=0.0055 --window='540-560' --points=500 --test > EAS-h2o-hf-cvs
generic_test EAS-h2o-hf-cvs

# cleaning
rm -f *.50
