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updated get_fci_tc_conv.sh

This commit is contained in:
eginer 2024-05-06 17:47:48 +02:00
parent 76732ff299
commit 7335e29784

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@ -1,2 +1,2 @@
file=$1
grep "Ndet,E,E+PT2,E+RPT2,|PT2|=" $file | cut -d "=" -f 2 > ${file}.conv_fci_tc
grep "Ndet,E,E+PT2,pt2_minus,pt2_plus,pt2_abs=" $file | cut -d "=" -f 2 > ${file}.conv_fci_tc