Commit cc5c6ffd authored by Robin Hilgers's avatar Robin Hilgers

Last try for today to fix this test.

parent 10c12468
......@@ -5,7 +5,7 @@
</comment>
<calculationSetup>
<cutoffs Kmax="3.50000000" Gmax="10.50000000" GmaxXC="10.50000000" numbands="0"/>
<scfLoop itmax="55" minDistance=".00001000" maxIterBroyd="99" imix="Anderson" alpha=".05000000" precondParam="0.0" spinf="2.00000000"/>
<scfLoop itmax="1" minDistance=".00001000" maxIterBroyd="99" imix="Anderson" alpha=".05000000" precondParam="0.0" spinf="2.00000000"/>
<coreElectrons ctail="f" frcor="F" kcrel="0" coretail_lmax="0"/>
<magnetism jspins="2" l_noco="t" swsp="F" lflip="t"/>
<soc theta=".00000000" phi=".00000000" l_soc="F" spav="F"/>
......
......@@ -4,8 +4,7 @@ $test_stages=2;
$test_desc=<<EOF
Simple test of Fleur with three steps:
1.Generate a rotated starting density and run 1 iteration
2.Calculate magnetization
Uses: LDA+U,forces
2.Calculate magnetization and check it's value.
EOF
;
......@@ -3,8 +3,10 @@ jt::copyfile("files/kpts.xml","$workdir/kpts.xml");
jt::copyfile("files/sym.xml","$workdir/sym.xml");
jt::testrun($executable,$workdir);
jt::testrun("rm inp.xml",$workdir);
$result+=jt::test_fileexists("$workdir/out");
$result=jt::test_grepexists("$workdir/out","flip");
jt::stageresult($workdir,$result,"1");
jt::stageresult($workdir,$result,1);
......@@ -4,7 +4,7 @@ jt::testrun($executable,$workdir);
$result=jt::test_grep_lastnumber("$workdir/out","mx=",".*= *([^ ]*)",2.116,0.001);
jt::stageresult($workdir,$result,"2");
jt::stageresult($workdir,$result,2);
......
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