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Problem phonon calculation buffer size

From: "Diego Moreno" <diegovmorenor@gmail.com>
To: forum@abinit.org
Subject: Problem phonon calculation buffer size
Date: Thu, 11 Oct 2007 14:37:29 -0500
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Dear abinit users,

I have problem, when runing phonon calculation, the system is gama-CuSe, abinit version 5.4.3 compiler ifort, mpich version 1.0.5,

the error .... log

wfsinp : enter
-P-0000 initwf : disk file gives npw= 19714 nband=    53 for k pt number=    1
.......
-P-0000 initwf :    53 bands have been initialized from disk
-P-0000 leave_test : synchronization done...
wfsinp: loop on k-points and spins done in parallel
pareigocc : MPI_ALLREDUCE
-P-0000 leave_test : synchronization done...
wfsinp: loop on k-points done in parallel
-P-0000 - newkpt: read input wf with ikpt,npw=   1   19714, make ikpt,npw=   1   19714
......
-P-0000 - newkpt: read input wf with ikpt,npw=   4   19710, make ikpt,npw= 18   19710
-P-0000 leave_test : synchronization done...
newkpt: loop on k-points done in parallel
pareigocc : MPI_ALLREDUCE

loper3 : eigenq array
Initialisation of the first-order wave-functions :
ireadwf=   0
-P-0000 wfconv :    53 bands set=0 with npw= 19714, for ikpt=   1
......
-P-0000 wfconv :    53 bands set=0 with npw= 19710, for ikpt= 18
-P-0000 leave_test : synchronization done...
newkpt: loop on k-points done in parallel
pareigocc : MPI_ALLREDUCE

forrtl: severe (41): insufficient virtual memory
Image              PC        Routine            Line        Source
abinip             0937731C Unknown               Unknown Unknown
abinip             09375AB5 Unknown               Unknown Unknown
abinip             09340EBA Unknown               Unknown Unknown
abinip             0930D4C8 Unknown               Unknown Unknown
abinip             0932BF61 Unknown               Unknown Unknown
abinip             0932BE9B Unknown               Unknown Unknown
abinip             08389F1C Unknown               Unknown Unknown
abinip             082B504D Unknown               Unknown Unknown
abinip             08062E46 Unknown               Unknown Unknown
abinip             0804FF01 Unknown               Unknown Unknown
abinip             0804AF66 Unknown               Unknown Unknown
libc.so.6          A7855EA8 Unknown               Unknown Unknown
abinip             0804AEA1 Unknown               Unknown Unknown
forrtl: severe (41): insufficient virtual memory
Image              PC        Routine            Line        Source
abinip             0937731C Unknown               Unknown Unknown
abinip             09375AB5 Unknown               Unknown Unknown
abinip             09340EBA Unknown               Unknown Unknown
abinip             0930D4C8 Unknown               Unknown Unknown
abinip             0932BF61 Unknown               Unknown Unknown
abinip             0932BE9B Unknown               Unknown Unknown
abinip             08389F1C Unknown               Unknown Unknown
abinip             082B504D Unknown               Unknown Unknown
abinip             08062E46 Unknown               Unknown Unknown
abinip             0804FF01 Unknown               Unknown Unknown
abinip             0804AF66 Unknown               Unknown Unknown
libc.so.6          A7910EA8 Unknown               Unknown Unknown
abinip             0804AEA1 Unknown               Unknown Unknown
rank 1 in job 2 meknes_38979   caused collective abort of all ranks
exit status of rank 1: return code 41

best regards

Diego Moreno

Attachment: fonon.in
Description: Binary data

Problem phonon calculation buffer size, Diego Moreno, 10/11/2007
- RE: [abinit-forum] Problem phonon calculation buffer size, jian sun, 10/11/2007