From: hackbard Date: Tue, 12 Feb 2008 21:18:50 +0000 (+0100) Subject: more structured run script (concerning visualization) X-Git-Url: https://hackdaworld.org/cgi-bin/gitweb.cgi?a=commitdiff_plain;h=f2db9f09b4a5d328165745b96c58c24ff03b0efd;p=physik%2Fposic.git more structured run script (concerning visualization) --- diff --git a/run b/run index 67d6d73..b46f2ca 100755 --- a/run +++ b/run @@ -8,10 +8,20 @@ fi if [ "$?" == "0" ]; then #./perms if [ "$1" ] ; then + # whole simulation cell #./visualize -w 640 -h 480 -d $1 - #./visualize -w 640 -h 480 -d $1 -nll -2.4 -2.4 -2.4 -fur 3.8 3.8 3.8 -b -2.03 -2.03 -2.03 3.39 3.39 3.39 -r 0.6 -c 1.5 -15.0 1.5 -B 0.1 + + # center unit cell + ./visualize -w 640 -h 480 -d $1 \ + -nll -2.4 -2.4 -2.4 -fur 3.8 3.8 3.8 \ + -b -2.03 -2.03 -2.03 3.39 3.39 3.39 \ + -r 0.6 -c 1.5 -15.0 1.5 -B 0.1 + + # old rasmol #rasmol -32 -nodisplay < $1/visualize.scr > /dev/null 2>&1 - #./ppm2avi $1 + ./ppm2avi $1 + + # copy config and main prog cp -v sic.c $1/sic.c cp -v config.h $1/config.h fi