[Wien] LAPW2 crashed in parallel mode

Hong, SamPyo likedew at phys.ksu.edu
Thu Feb 5 17:39:45 CET 2004


Hi,
Sorry for sending this email without your permission.
I'm emailing you because I have the same error you once had.
It's gonna be really helpful if you would teach me how you solved the
problem.
You said it was with .cshrc script. What was that?

Take my regards,

Sampyo

-----Original Message-----
From: wien-admin at zeus.theochem.tuwien.ac.at
[mailto:wien-admin at zeus.theochem.tuwien.ac.at] On Behalf Of Lo Achd
Sent: Monday, January 19, 2004 6:59 PM
To: wien at zeus.theochem.tuwien.ac.at
Subject: Re: [Wien] LAPW2 crashed in parallel mode


I had found the problem. It is because the file of .cshrc

Sorry for my stupid question


>From: "Lo Achd" <wien_lo_7 at hotmail.com>
>Reply-To: wien at zeus.theochem.tuwien.ac.at
>To: wien at zeus.theochem.tuwien.ac.at
>Subject: Re: [Wien] LAPW2 crashed in parallel mode
>Date: Mon, 19 Jan 2004 11:01:26 +0000
>
>Dear Prof. Blaha
>
>Thank you very much for your help!
>
>I am very surprised that no uplapw2_1.def  !!!
>
>And the uplapw2.def is:
>
>2,'PP.nshup',    'unknown','formatted',0
>3,'PP.in1',   'unknown','formatted',0
>4,'PP.inso',           'unknown','formatted',0
>5,'PP.in2',   'old',    'formatted',0
>6,'PP.output2up','unknown','formatted',0
>8,'PP.clmvalup','unknown','formatted',0
>10,'PP.vectorup', 'unknown','unformatted',9000
>11,'PP.weightup',    'unknown','formatted',0
>13,'PP.recprlist',      'unknown','unformatted',9000
>14,'PP.kgen',        'unknown','formatted',0
>15,'PP.tmpup',       'unknown','formatted',0
>16,'PP.qtlup',       'unknown','formatted',0
>17,'PP.weightaverup','unknown','formatted',0
>18,'PP.vspup',       'old',    'formatted',0
>98,'PP.vspdn',       'old',    'formatted',0
>19,'PP.vnsup',       'unknown','formatted',0
>20,'PP.struct',         'old',    'formatted',0
>21,'PP.scf2up',   'unknown','formatted',0
>22,'PP.rotlm',   'unknown',    'formatted',0
>23,'PP.radwf',   'unknown',    'formatted',0
>24,'PP.almblm',   'unknown',    'formatted',0
>26,'PP.weighup',   'unknown','unformatted',0
>27,'PP.weighdn',   'unknown','unformatted',0
>28,'PP.vrespvalup',   'unknown','formatted',0
>29,'PP.energydn','unknown','formatted',0
>30,'PP.energyup', 'unknown','formatted',0
>31,'PP.helpup', 'unknown','formatted',0
>
>Maybe some script is wrong or lack?
>
>The operate-system is Linux version 2.4.17-4
>
>Best regards
>
>Lo
>
>
>
>
>>From: Peter Blaha <pblaha at zeus.theochem.tuwien.ac.at>
>>Reply-To: wien at zeus.theochem.tuwien.ac.at
>>To: wien at zeus.theochem.tuwien.ac.at
>>Subject: Re: [Wien] LAPW2 crashed in parallel mode
>>Date: Mon, 19 Jan 2004 10:52:26 +0100 (CET)
>>
>>
>>.machines looks ok.
>>
>>How does  uplapw2.def   and uplapw2_1.def look like ?
>>
>>Maybe you have an ill defined SCRATCH variable.
>>What gives    echo $SCRATCH
>>
>> > > > When I run "runsp -p" at my PC-cluster, the lapw2 crashed:
>> > > > -------------------------
>> > > > ./runsp -p
>> > > > STOP  LAPW0 END statement executed
>> > > > STOP  LAPW1 END statement executed
>> > > > STOP  LAPW1 END statement executed
>> > > > STOP  LAPW1 END statement executed
>> > > > STOP  LAPW1 END statement executed
>> > > > STOP  LAPW1 END statement executed
>> > > > STOP  LAPW1 END statement executed
>> > > > STOP  LAPW1 END statement executed
>> > > > STOP  LAPW1 END statement executed
>> > > > STOP FERMI - Error statement executed
>> > > > cp: cannot stat `.in.tmp': No such file or directory
>> > > > rm: cannot remove `.in.tmp': No such file or directory
>> > > > rm: cannot remove `.in.tmp1': No such file or directory
>> > > > --------------------------------
>> > > >
>> > > > When I input "ls -l *.error"
>> > > > -rw-r--r--    1 lo    users           0 Jan 19 10:20
dndstart.error
>> > > > -rw-r--r--    1 lo    users           0 Jan 19 10:53
dnlapw1.error
>> > > > -rw-r--r--    1 lo    users           0 Jan 19 10:53 
>>dnlapw1_1.error
>> > > > -rw-r--r--    1 lo    users           0 Jan 19 10:53 
>>dnlapw1_2.error
>> > > > -rw-r--r--    1 lo    users           0 Jan 19 10:53 
>>dnlapw1_3.error
>> > > > -rw-r--r--    1 lo    users           0 Jan 19 10:53 
>>dnlapw1_4.error
>> > > > -rw-r--r--    1 lo    users           0 Jan 19 10:20
dstart.error
>> > > > -rw-r--r--    1 lo    users           0 Jan 19 10:52
lapw0.error
>> > > > -rw-r--r--    1 lo    users           0 Jan 19 10:20
updstart.error
>> > > > -rw-r--r--    1 lo    users         197 Jan 19 10:53
uplapw2.error
>> > > >
>> > > >
>> > > > and "cat uplapw2.error"
>> > > >
>> > > > 'LAPW2' - can't open unit:
>> > > > 'LAPW2' -        filename:
>> > > > @@@@@@@@@@@@@@@@@@@@@@@@@@@@@@@@@@@@@@@@@@@@@@@@@@
>> > > > **  testerror: Error in Parallel LAPW2
>> > > >
>> > > >
>> > > > The material I try to calculate is Co-hcp, I had calculated it 
>> > > > many
>>time
>> > >in
>> > > > the non-parallel mode. I had spent about 1 day to read the
>> > >old-mail-list,
>> > > > but cannot resolve my problem.
>> > > >
>> > > > What I can do?
>> > > >
>> > > > best regards
>> > > >
>> > > > Lo
>> > > >
>> > > > _______________________________________________________________
>> > > > __
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>> > >
>> > >
>> > >                                       P.Blaha
>> > 
>> >--------------------------------------------------------------------
>> >------
>> > >Peter BLAHA, Inst.f. Materials Chemistry, TU Vienna, A-1060 Vienna
>> > >Phone: +43-1-58801-15671             FAX: +43-1-58801-15698
>> > >Email: blaha at theochem.tuwien.ac.at    WWW:
>> > >http://info.tuwien.ac.at/theochem/
>> > 
>> >--------------------------------------------------------------------
>> >------
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>>
>>
>>                                       P.Blaha
>>----------------------------------------------------------------------
>>----
>>Peter BLAHA, Inst.f. Materials Chemistry, TU Vienna, A-1060 Vienna
>>Phone: +43-1-58801-15671             FAX: +43-1-58801-15698
>>Email: blaha at theochem.tuwien.ac.at    WWW: 
>>http://info.tuwien.ac.at/theochem/
>>----------------------------------------------------------------------
----
>>
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