From: hackbard <hackbard@sage.physik.uni-augsburg.de>
Date: Thu, 16 Aug 2007 16:27:55 +0000 (+0200)
Subject: added very simple delta e calc script
X-Git-Url: https://hackdaworld.org/cgi-bin/gitweb.cgi?a=commitdiff_plain;h=f016cb236d41d1e07a35fdbf1148ee53b7c0da0d;p=physik%2Fposic.git

added very simple delta e calc script
---

diff --git a/calc_delta_e b/calc_delta_e
new file mode 100755
index 0000000..9c5ecda
--- /dev/null
+++ b/calc_delta_e
@@ -0,0 +1,9 @@
+#!/bin/bash
+
+e0=`grep ^0 $1/energy | awk '{ print $4 }'`
+e1=`tail -n 1 $1/energy | awk '{ print $4 }'`
+ev=`grep ^19.000 $1/energy | awk '{ print $4 }'`
+en=`grep ^20.000 $1/energy | awk '{ print $4 }'`
+
+echo "$e0 $e1 $2 $ev $en" | \
+	awk '{ print $5*($3+1)-$4*$3-($2*($3+1)-$1*$3) " eV" }'