[Wien] Lapwso crashed when running the program in parallel mode

Madhav Ghimire ghimire.mpg at gmail.com
Mon Mar 19 07:10:27 CET 2012


Dear Peter Blaha and wien users,
     I am facing problems in running the spin-orbit coupling in parallel
mode while trying to calculate the band structure.
Initially I could successfully run the scf cycles and able to calculate
DOS. But when I run the program of band structure by invoking the command x
lapwso -orb -c -up -p and x lapwso -orb -c -dn -p after x lapw1 -band -orb
-c -up -p and x lapw1 -band -orb -c -dn -p, I observe an error as sorted
below:

[1] 10753
[2] 10760
[3] 10768
[4] 10776
[5] 10783
[6] 10790
[7] 10797
[8] 10804
[9] 10811
[10] 10818
[11] 10825
[12] 10832
[13] 10839
[14] 10846
[15] 10853
[16] 10860
[17] 10867
[18] 10874
[19] 10881
[20] 10888
[21] 10895
[22] 10903
[23] 10912
[24] 10920
[25] 10929
[26] 10936
[27] 10944
[28] 10951
[29] 10958
[30] 10965
[31] 10972
[32] 10979
ssh: connect to host r4i1n3 port 22: Connection timed out
[1]    Done                          ( ( $remote $machine[$p] "cd $PWD;$t
$exe ${def}_${loop}.def"; rm -f  ...
ssh: connect to host r4i1n3 port 22: Connection timed out
[2]    Done                          ( ( $remote $machine[$p] "cd $PWD;$t
$exe ${def}_${loop}.def"; rm -f  ...
ssh: connect to host r4i1n3 port 22: Connection timed out
[3]    Done                          ( ( $remote $machine[$p] "cd $PWD;$t
$exe ${def}_${loop}.def"; rm -f  ...
ssh: connect to host r4i1n3 port 22: Connection timed out
[4]    Done                          ( ( $remote $machine[$p] "cd $PWD;$t
$exe ${def}_${loop}.def"; rm -f  ...
[1] 11590
ssh: connect to host r4i1n3 port 22: Connection timed out
[5]    Done                          ( ( $remote $machine[$p] "cd $PWD;$t
$exe ${def}_${loop}.def"; rm -f  ...
[2] 11600
ssh: connect to host r4i1n3 port 22: Connection timed out
[6]    Done                          ( ( $remote $machine[$p] "cd $PWD;$t
$exe ${def}_${loop}.def"; rm -f  ...
[3] 11610
ssh: connect to host r4i1n3 port 22: Connection timed out
[7]    Done                          ( ( $remote $machine[$p] "cd $PWD;$t
$exe ${def}_${loop}.def"; rm -f  ...
[4] 11620
ssh: connect to host r4i1n3 port 22: Connection timed out
[8]    Done                          ( ( $remote $machine[$p] "cd $PWD;$t
$exe ${def}_${loop}.def"; rm -f  ...
[5] 11630
ssh: connect to host r4i1n14 port 22: Connection timed out
[9]    Done                          ( ( $remote $machine[$p] "cd $PWD;$t
$exe ${def}_${loop}.def"; rm -f  ...
ssh: connect to host r4i1n14 port 22: Connection timed out
ssh: connect to host r4i1n14 port 22: Connection timed out
ssh: connect to host r4i1n14 port 22: Connection timed out
ssh: connect to host r4i1n14 port 22: Connection timed out
ssh: connect to host r4i1n14 port 22: Connection timed out
ssh: connect to host r4i1n14 port 22: Connection timed out
ssh: connect to host r4i1n14 port 22: Connection timed out
ssh: connect to host r4i3n4 port 22: Connection timed out
ssh: connect to host r4i3n4 port 22: Connection timed out
ssh: connect to host r4i3n4 port 22: Connection timed out
ssh: connect to host r4i3n4 port 22: Connection timed out
ssh: connect to host r4i3n4 port 22: Connection timed out
ssh: connect to host r4i3n4 port 22: Connection timed out
ssh: connect to host r4i3n4 port 22: Connection timed out
ssh: connect to host r4i3n4 port 22: Connection timed out
ssh: connect to host r4i3n11 port 22: Connection timed out
ssh: connect to host r4i3n11 port 22: Connection timed out
ssh: connect to host r4i3n11 port 22: Connection timed out
ssh: connect to host r4i3n11 port 22: Connection timed out
ssh: connect to host r4i3n11 port 22: Connection timed out
ssh: connect to host r4i3n11 port 22: Connection timed out
ssh: connect to host r4i3n11 port 22: Connection timed out
ssh: connect to host r4i3n11 port 22: Connection timed out
ssh: connect to host r4i1n3 port 22: Connection timed out
ssh: connect to host r4i1n3 port 22: Connection timed out
ssh: connect to host r4i1n3 port 22: Connection timed out
ssh: connect to host r4i1n3 port 22: Connection timed out
ssh: connect to host r4i1n3 port 22: Connection timed out
[5]    Done                          ( ( $remote $machine[$p] "cd $PWD;$t
$exe ${def}_${loop}.def"; rm -f  ...
[4]  - Done                          ( ( $remote $machine[$p] "cd $PWD;$t
$exe ${def}_${loop}.def"; rm -f  ...
[3]  + Done                          ( ( $remote $machine[$p] "cd $PWD;$t
$exe ${def}_${loop}.def"; rm -f  ...
[2]  + Done                          ( ( $remote $machine[$p] "cd $PWD;$t
$exe ${def}_${loop}.def"; rm -f  ...
[1]  + Done                          ( ( $remote $machine[$p] "cd $PWD;$t
$exe ${def}_${loop}.def"; rm -f  ...
[32] + Done                          ( ( $remote $machine[$p] "cd $PWD;$t
$exe ${def}_${loop}.def"; rm -f  ...
[31] + Done                          ( ( $remote $machine[$p] "cd $PWD;$t
$exe ${def}_${loop}.def"; rm -f  ...
[30] + Done                          ( ( $remote $machine[$p] "cd $PWD;$t
$exe ${def}_${loop}.def"; rm -f  ...
[29] + Done                          ( ( $remote $machine[$p] "cd $PWD;$t
$exe ${def}_${loop}.def"; rm -f  ...
[28] + Done                          ( ( $remote $machine[$p] "cd $PWD;$t
$exe ${def}_${loop}.def"; rm -f  ...
[27] + Done                          ( ( $remote $machine[$p] "cd $PWD;$t
$exe ${def}_${loop}.def"; rm -f  ...
[26] + Done                          ( ( $remote $machine[$p] "cd $PWD;$t
$exe ${def}_${loop}.def"; rm -f  ...
[25] + Done                          ( ( $remote $machine[$p] "cd $PWD;$t
$exe ${def}_${loop}.def"; rm -f  ...
[24] + Done                          ( ( $remote $machine[$p] "cd $PWD;$t
$exe ${def}_${loop}.def"; rm -f  ...
[23] + Done                          ( ( $remote $machine[$p] "cd $PWD;$t
$exe ${def}_${loop}.def"; rm -f  ...
[22] + Done                          ( ( $remote $machine[$p] "cd $PWD;$t
$exe ${def}_${loop}.def"; rm -f  ...
[21] + Done                          ( ( $remote $machine[$p] "cd $PWD;$t
$exe ${def}_${loop}.def"; rm -f  ...
[20] + Done                          ( ( $remote $machine[$p] "cd $PWD;$t
$exe ${def}_${loop}.def"; rm -f  ...
[19] + Done                          ( ( $remote $machine[$p] "cd $PWD;$t
$exe ${def}_${loop}.def"; rm -f  ...
[18] + Done                          ( ( $remote $machine[$p] "cd $PWD;$t
$exe ${def}_${loop}.def"; rm -f  ...
[17] + Done                          ( ( $remote $machine[$p] "cd $PWD;$t
$exe ${def}_${loop}.def"; rm -f  ...
[16] + Done                          ( ( $remote $machine[$p] "cd $PWD;$t
$exe ${def}_${loop}.def"; rm -f  ...
[15] + Done                          ( ( $remote $machine[$p] "cd $PWD;$t
$exe ${def}_${loop}.def"; rm -f  ...
[14] + Done                          ( ( $remote $machine[$p] "cd $PWD;$t
$exe ${def}_${loop}.def"; rm -f  ...
[13] + Done                          ( ( $remote $machine[$p] "cd $PWD;$t
$exe ${def}_${loop}.def"; rm -f  ...
[12] + Done                          ( ( $remote $machine[$p] "cd $PWD;$t
$exe ${def}_${loop}.def"; rm -f  ...
[11] + Done                          ( ( $remote $machine[$p] "cd $PWD;$t
$exe ${def}_${loop}.def"; rm -f  ...
[10] + Done                          ( ( $remote $machine[$p] "cd $PWD;$t
$exe ${def}_${loop}.def"; rm -f  ...
**  LAPWSO crashed!
0.480u 1.000s 6:27.48 0.3%    0+0k 0+0io 3pf+0w
error: command   /home/ghimire123/WIEN2k_11/lapwsopara -up -c lapwso.def
failed
Hope some users also faced this type of error while handling parallel mode
computation. Please have a look at it.
In the meantime, I am
Thank you in advance
Best wishes

-- 
M. P. Ghimire
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