Hi siesta users,

I saw your email in the mail list. I encounter the same problem as you
described in the email. It seems that my jobs can be run smoothly on a core
(not a note), but the jobs will be aborted after the first CG/MD step when
I used multi-cores to run the jobs. So did you solve the problem or any
idea with my problem?  Thanks so much.

Have a good day

Ting Zheng




2014-12-03 0:27 GMT-06:00 joyce79928cc . <[email protected]>:

> yes
>
> --
> Best Regards
>
> 邱芳瑜  Chiu Fang Yu
> 國立成功大學 材料科學與工程學系碩二
> MOBILE:0930287221(中華)
> GMAIL:[email protected] <[email protected]>
>
>
>
> 2014-12-03 14:18 GMT+08:00 邵德喜 <[email protected]>:
>
>> Is that completed successfully?
>>
>> 2014-12-03 11:06 GMT+08:00 joyce79928cc . <[email protected]>:
>>
>> I changed my job to 1core calculation job
>>>
>>>
>>> --
>>> Best Regards
>>>
>>> 邱芳瑜  Chiu Fang Yu
>>> 國立成功大學 材料科學與工程學系碩二
>>> MOBILE:0930287221(中華)
>>> GMAIL:[email protected] <[email protected]>
>>>
>>>
>>>
>>> 2014-12-03 10:31 GMT+08:00 邵德喜 <[email protected]>:
>>>
>>>> Have you ever solved the problem yet?
>>>> I've found that this problem occurs in the part of transiesta
>>>> calculation, then all of the jobs shut down at the same point from the
>>>> OUTPUT just as follows:
>>>>
>>>>  TRANSIESTA: Initializing lists
>>>> From SIESTA: Efermi=  -4.358
>>>> qc0 :   0.000
>>>> qcn0 : 250.519
>>>>  nou,NGL,NGR:        1664         208         208
>>>> rank 20 in job 1  i02n10_59047   caused collective abort of all ranks
>>>>   exit status of rank 20: killed by signal 9
>>>> Job
>>>>  /fs00/software/lsf/9.1/linux2.6-glibc2.3-x86_64/bin/intelmpi_wrapper
>>>> /fs08/home/js_dxshao/bin/transiesta
>>>>
>>>> TID   HOST_NAME   COMMAND_LINE            STATUS
>>>>  TERMINATION_TIME
>>>> ===== ========== ================  =======================
>>>>  ===================
>>>> 00000 i02n10     /fs08/home/js_dx  Exit (status unknown)
>>>>
>>>> 00001 i02n10     /fs08/home/js_dx  Exit (status unknown)
>>>>
>>>> It's really so kind of all to give any advice ang guidence.
>>>> Thanks in advance!
>>>>
>>>> 2014-11-30 20:13 GMT+08:00 joyce79928cc . <[email protected]>:
>>>>
>>>> Today I got this error, too
>>>>>
>>>>> --
>>>>> Best Regards
>>>>>
>>>>> 邱芳瑜  Chiu Fang Yu
>>>>> 國立成功大學 材料科學與工程學系碩二
>>>>> MOBILE:0930287221(中華)
>>>>> GMAIL:[email protected] <[email protected]>
>>>>>
>>>>>
>>>>>
>>>>> 2014-11-30 16:52 GMT+08:00 邵德喜 <[email protected]>:
>>>>>
>>>>>> Dear all:
>>>>>> I‘m sorry to disturb but today when I take transiesta calculation,
>>>>>> error as follows occured:
>>>>>> forrtl: severe (174): SIGSEGV, segmentation fault occurred
>>>>>> Any suggestion will be appreciated.
>>>>>> Dexi Shao
>>>>>>
>>>>>
>>>>>
>>>>
>>>
>>
>

Responder a