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modified qp_e_conv_fci for pdf

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This commit is contained in:
Emmanuel Giner 2019-01-04 02:18:54 +01:00
parent d924386eed
commit 7d5b24f404
1 changed files with 4 additions and 4 deletions
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8
scripts/qp_e_conv_fci
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@ -13,8 +13,8 @@ for i in `seq 1 $nstates`
do
out=${1}.${i}.conv
cat << EOF > ${out}.plt
set term eps
set output "$out.eps"
set term pdf
set output "$out.pdf"
set log x
set xlabel "Number of determinants"
set ylabel "Total Energy (a.u.)"
@ -32,8 +32,8 @@ for i in `seq 2 $nstates`
do
out=${1}.${i}.delta_e.conv
cat << EOF > ${out}.plt
set term eps
set output "$out.eps"
set term pdf
set output "$out.pdf"
set log x
set xlabel "Number of determinants"
set ylabel "Energy difference (a.u.)"