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            Last change
 on this file since 201832 was             a0bcf1, checked in by Frederik Heber <heber@…>, 18 years ago           | 
        
        
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-initial commit 
-Minimum set of files needed from ESPACK SVN repository 
-Switch to three tantamount package parts instead of all relating to pcp (as at some time Ralf's might find inclusion as well) 
 
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Property                 mode
 set to                 
100755
               
             
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            File size:
            606 bytes
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| [a0bcf1] | 1 | #!/bin/sh
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 | 2 | #
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 | 3 | # Collects last lines from different ecut dirs into results${suf} for plotting
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 | 4 | 
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 | 5 | . suffix
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 | 6 | 
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 | 7 | if [ -z "$2" ]; then
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 | 8 |         echo "Usage: $0 <molecule dir> <variable>"
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 | 9 |         echo "e.g. ./$0 /tmp/C2H6 sigma_i0_t1"
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 | 10 |         exit 1
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 | 11 | fi
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 | 12 | 
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 | 13 | ecuts=1
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 | 14 | i=1
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 | 15 | while   [ "$i" -lt 128 ]; do
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 | 16 |         let i=$i+1
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 | 17 |         ecuts="$ecuts $i"
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 | 18 | done
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 | 19 | 
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 | 20 | #echo $ecuts
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 | 21 | #exit 1
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 | 22 | 
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 | 23 | . suffix
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 | 24 | 
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 | 25 | RES="${1}/results-$2${suf}"
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 | 26 | DATE="`date`"
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 | 27 | echo "# Results of variable $2 from molecule $1, gathered on $date" >$RES
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 | 28 | 
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 | 29 | # gather last lines
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 | 30 | for i in $ecuts; do
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 | 31 |         if [ -e "${1}/${i}Ht/pcp.${2}${suf}" ]; then
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 | 32 |                 tail -n 1 ${1}/${i}Ht/pcp.${2}${suf} >>$RES 2>>/dev/null
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 | 33 |         fi
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 | 34 | done
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 | 35 | 
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 | 36 | exit 0
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