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Commit 0fc1ffc6 authored by Mika Kurki's avatar Mika Kurki
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Replace submit.pl

parent 661fb536
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......@@ -29,7 +29,7 @@ print "Host: $host\n";
# Prepare LAMMPS input files
#-------------------------------------------------------
my $simTemp = 300;
my $simTemp = 650;
my $runLength = 300000000;
my $lc;
my $rmin;
......@@ -54,6 +54,7 @@ $dumpFile .= "K.dump";
if ($simTemp == 10) { $lc = 3.615574515; }
elsif (($simTemp > 10) && ($simTemp < 150)) { $lc = 3.615574515 + (3.623766727241576-3.615574515)/140*($simTemp-150); }
elsif ($simTemp == 150) { $lc = 3.623766727241576; }
elsif ($simTemp == 200) { $lc = 3.626722529754426; }
elsif ($simTemp == 250) { $lc = 3.62967287704169; }
......@@ -64,6 +65,7 @@ elsif ($simTemp == 450) { $lc = 3.64204937; }
elsif ($simTemp == 500) { $lc = 3.6452984649914337; }
elsif ($simTemp == 550) { $lc = 3.6485884740148484; }
elsif ($simTemp == 600) { $lc = 3.651712545; }
elsif (($simTemp > 600) && ($simTemp < 900)) { $lc = 3.651712545 + (3.673115995-3.651712545)/300*($simTemp-600); }
elsif ($simTemp == 900) { $lc = 3.673115995; }
elsif ($simTemp == 1200) { $lc = 3.69799744; }
elsif ($simTemp == 1500) { $lc = 3.729917445; }
......
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