| Last change
 on this file since 255d13 was             a0bcf1, checked in by Frederik Heber <heber@…>, 18 years ago | 
        
          | 
-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)
 
 | 
        
          | 
              
Property                 mode
 set to                 100755 | 
        
          | File size:
            606 bytes | 
      
      
| Rev | Line |  | 
|---|
| [a0bcf1] | 1 | #!/bin/sh | 
|---|
|  | 2 | # | 
|---|
|  | 3 | # Collects last lines from different ecut dirs into results${suf} for plotting | 
|---|
|  | 4 |  | 
|---|
|  | 5 | . suffix | 
|---|
|  | 6 |  | 
|---|
|  | 7 | if [ -z "$2" ]; then | 
|---|
|  | 8 | echo "Usage: $0 <molecule dir> <variable>" | 
|---|
|  | 9 | echo "e.g. ./$0 /tmp/C2H6 sigma_i0_t1" | 
|---|
|  | 10 | exit 1 | 
|---|
|  | 11 | fi | 
|---|
|  | 12 |  | 
|---|
|  | 13 | ecuts=1 | 
|---|
|  | 14 | i=1 | 
|---|
|  | 15 | while   [ "$i" -lt 128 ]; do | 
|---|
|  | 16 | let i=$i+1 | 
|---|
|  | 17 | ecuts="$ecuts $i" | 
|---|
|  | 18 | done | 
|---|
|  | 19 |  | 
|---|
|  | 20 | #echo $ecuts | 
|---|
|  | 21 | #exit 1 | 
|---|
|  | 22 |  | 
|---|
|  | 23 | . suffix | 
|---|
|  | 24 |  | 
|---|
|  | 25 | RES="${1}/results-$2${suf}" | 
|---|
|  | 26 | DATE="`date`" | 
|---|
|  | 27 | echo "# Results of variable $2 from molecule $1, gathered on $date" >$RES | 
|---|
|  | 28 |  | 
|---|
|  | 29 | # gather last lines | 
|---|
|  | 30 | for i in $ecuts; do | 
|---|
|  | 31 | if [ -e "${1}/${i}Ht/pcp.${2}${suf}" ]; then | 
|---|
|  | 32 | tail -n 1 ${1}/${i}Ht/pcp.${2}${suf} >>$RES 2>>/dev/null | 
|---|
|  | 33 | fi | 
|---|
|  | 34 | done | 
|---|
|  | 35 |  | 
|---|
|  | 36 | exit 0 | 
|---|
       
      
  Note:
 See   
TracBrowser
 for help on using the repository browser.