[Wien] BerryPI spin-orbit?

Oleg Rubel orubel at lakeheadu.ca
Tue Jul 7 23:09:30 CEST 2015


It is ‘-j’ option. You can get a list of options by executing 'berrypi -h’

Oleg

> On Jul 7, 2015, at 17:05, Parker, David S. <parkerds at ornl.gov> wrote:
> 
> Has anyone succeeded in running BerryPI with spin-orbit? I am using
> BerryPI1.3 with the latest WIEN2K version but is is not clear to me what
> flags or args one uses to run with spin-orbit. Any help is greatly
> appreciated - David Parker
> 
> On 7/7/15, 2:01 PM, "Gavin Abo" <gsabo at crimson.ua.edu> wrote:
> 
>> X86_64-K1om-linux-ld => I think this is a linker for Intel Xeon Phi
>> coprocessors.  As the error message says, it cannot find the
>> X86_64-K1om-linux-ld file.  I guess that you have to install a redhat
>> package (I would expect that redhat support [
>> https://access.redhat.com/support/ ] would be able to tell what package
>> needs installed ) or Intel's Manycore Platform Software Stack (MSSP) [
>> https://software.intel.com/en-us/articles/intel-manycore-platform-software
>> -stack-mpss 
>> ] to get the file.
>> 
>> I don't see anything noticeable wrong with your compile settings, but it
>> should be better to use the recommended siteconfig settings as there are
>> differences.  For example, you don't have -assume buffered_io (or -assu
>> buff), which can be faster [
>> http://www.mail-archive.com/wien%40zeus.theochem.tuwien.ac.at/msg05711.htm
>> l 
>> ] and prevent NFS problems [
>> http://www.mail-archive.com/wien%40zeus.theochem.tuwien.ac.at/msg03171.htm
>> l 
>> ].
>> 
>> Maybe, the segmentation fault is related to Xeon Phi coprocessors, but I
>> don't have experience using a Xeon Phi coprocessor.
>> 
>> On 7/7/2015 4:26 AM, shamik chakrabarti wrote:
>>> Dear wien2k users,
>>> 
>>>    We are trying to install wien2k in a server with Red Hat Linux.
>>> The compiler used for the installation is composer_xe_2015.0.090
>>> 
>>> Two errors were appeared during installation as being seen from
>>> compiler.msg
>>> 
>>> 1) X86_64-K1om-linux-ld: No such file or directory......Error 100
>>> 
>>> 2) segmentation fault (core dumped)........Error 2
>>> 
>>> I am giving the settings of OPTION below
>>> 
>>> current:FOPT:-FR -mp1 -w -prec_div -pc80 -pad -ip -traceback
>>> current:LDFLAGS:$(FOPT) -L$(MKLROOT)/lib/$(MKL_TARGET_ARCH) -lpthread
>>> current:DPARALLEL:'-DParallel'
>>> current:R_LIBS:-lmkl_lapack95_lp64 -lmkl_intel_lp64 -lmkl_intel_thread
>>> -lmkl_core -lpthread
>>> 
>>> Any response in this regard will be helpful for us.
>>> 
>>> Thanks in advance.
>>> 
>>> with regards,
>>> 
>>> -- 
>>> Shamik Chakrabarti
>>> Senior Research Fellow
>>> Dept. of Physics & Meteorology
>>> Material Processing & Solid State Ionics Lab
>>> IIT Kharagpur
>>> Kharagpur 721302
>>> INDIA
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> 
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