Re: [Wien] wien2k parallelization error
You cannot fine-grain parallelize lapw0, only mpi. If you want it to run on a different node (tyrone-node3) use a line lapw0: tyrone-node3 As mpi lapw0: tyrone-node3:4 This information is in the user guide. On Mon, Aug 22, 2016 at 8:10 AM, Soumen Bag wrote: > Thanks for the suggestion > for me > > granularity:1 > 1:tyrone-node3 > 1:tyrone-node3 > 1:tyrone-node3 > 1:tyrone-node3 > 1:tyrone-node3 > 1:tyrone-node3 > > this worked. this time i checked law1 and lapw2 run in parallel mode but > lapw0 was not. now my question what else should i add in the .machines file > to make it fine grain parallelization too? > > Thanks > > > Soumen Kumar Bag > Physical Science Dept. > IISC > > > On Sun, Aug 14, 2016 at 2:15 AM, Laurence Marks > wrote: >> >> Remove the two lines >> >> residue:compute-0-0:1 >> lapw1:compute-0-0:6 >> >> And try again. This may not solve the problem. >> >> On Sat, Aug 13, 2016 at 3:07 PM, Soumen Bag wrote: >> > Dear wien2k experts, >> > >> > I got following error while running "x lapw1 -p" >> > >> > starting parallel lapw1 at Sun Aug 14 01:26:54 IST 2016 >> > -> starting parallel LAPW1 jobs at Sun Aug 14 01:26:54 IST 2016 >> > running LAPW1 in parallel mode (using .machines) >> > @: Expression Syntax. >> > 0.042u 0.838s 0:00.32 271.8%0+0k 0+0io 0pf+0w >> > error: command /home/soumen/INSTALL-PACKAGES/wien2k_14_2_mpi/lapw1para >> > lapw1.def failed >> > >> > my .machines file is >> > granularity:1 >> > 1:compute-0-0:6 >> > residue:compute-0-0:1 >> > lapw0:compute-0-0:6 >> > lapw1:compute-0-0:6 >> > >> > >> > Soumen Kumar Bag >> > Physical Science Dept. >> > IISC >> > >> >> >> >> -- >> Professor Laurence Marks >> "Research is to see what everybody else has seen, and to think what >> nobody else has thought", Albert Szent-Gyorgi >> www.numis.northwestern.edu ; Corrosion in 4D: >> MURI4D.numis.northwestern.edu >> Partner of the CFW 100% program for gender equity, www.cfw.org/100-percent >> Co-Editor, Acta Cryst A >> ___ >> Wien mailing list >> Wien@zeus.theochem.tuwien.ac.at >> http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien >> SEARCH the MAILING-LIST at: >> http://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at/index.html > > -- Professor Laurence Marks "Research is to see what everybody else has seen, and to think what nobody else has thought", Albert Szent-Gyorgi www.numis.northwestern.edu ; Corrosion in 4D: MURI4D.numis.northwestern.edu Partner of the CFW 100% program for gender equity, www.cfw.org/100-percent Co-Editor, Acta Cryst A ___ Wien mailing list Wien@zeus.theochem.tuwien.ac.at http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien SEARCH the MAILING-LIST at: http://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at/index.html
Re: [Wien] wien2k parallelization error
Thanks for the suggestion for me granularity:1 1:tyrone-node3 1:tyrone-node3 1:tyrone-node3 1:tyrone-node3 1:tyrone-node3 1:tyrone-node3 this worked. this time i checked law1 and lapw2 run in parallel mode but lapw0 was not. now my question what else should i add in the .machines file to make it fine grain parallelization too? Thanks *Soumen Kumar Bag* *Physical Science Dept.* *IISC* On Sun, Aug 14, 2016 at 2:15 AM, Laurence Marks wrote: > Remove the two lines > > residue:compute-0-0:1 > lapw1:compute-0-0:6 > > And try again. This may not solve the problem. > > On Sat, Aug 13, 2016 at 3:07 PM, Soumen Bag wrote: > > Dear wien2k experts, > > > > I got following error while running "x lapw1 -p" > > > > starting parallel lapw1 at Sun Aug 14 01:26:54 IST 2016 > > -> starting parallel LAPW1 jobs at Sun Aug 14 01:26:54 IST 2016 > > running LAPW1 in parallel mode (using .machines) > > @: Expression Syntax. > > 0.042u 0.838s 0:00.32 271.8%0+0k 0+0io 0pf+0w > > error: command /home/soumen/INSTALL-PACKAGES/wien2k_14_2_mpi/lapw1para > > lapw1.def failed > > > > my .machines file is > > granularity:1 > > 1:compute-0-0:6 > > residue:compute-0-0:1 > > lapw0:compute-0-0:6 > > lapw1:compute-0-0:6 > > > > > > Soumen Kumar Bag > > Physical Science Dept. > > IISC > > > > > > -- > Professor Laurence Marks > "Research is to see what everybody else has seen, and to think what > nobody else has thought", Albert Szent-Gyorgi > www.numis.northwestern.edu ; Corrosion in 4D: > MURI4D.numis.northwestern.edu > Partner of the CFW 100% program for gender equity, www.cfw.org/100-percent > Co-Editor, Acta Cryst A > ___ > Wien mailing list > Wien@zeus.theochem.tuwien.ac.at > http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien > SEARCH the MAILING-LIST at: http://www.mail-archive.com/ > wien@zeus.theochem.tuwien.ac.at/index.html > ___ Wien mailing list Wien@zeus.theochem.tuwien.ac.at http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien SEARCH the MAILING-LIST at: http://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at/index.html
Re: [Wien] wien2k parallelization error
Remove the two lines residue:compute-0-0:1 lapw1:compute-0-0:6 And try again. This may not solve the problem. On Sat, Aug 13, 2016 at 3:07 PM, Soumen Bag wrote: > Dear wien2k experts, > > I got following error while running "x lapw1 -p" > > starting parallel lapw1 at Sun Aug 14 01:26:54 IST 2016 > -> starting parallel LAPW1 jobs at Sun Aug 14 01:26:54 IST 2016 > running LAPW1 in parallel mode (using .machines) > @: Expression Syntax. > 0.042u 0.838s 0:00.32 271.8%0+0k 0+0io 0pf+0w > error: command /home/soumen/INSTALL-PACKAGES/wien2k_14_2_mpi/lapw1para > lapw1.def failed > > my .machines file is > granularity:1 > 1:compute-0-0:6 > residue:compute-0-0:1 > lapw0:compute-0-0:6 > lapw1:compute-0-0:6 > > > Soumen Kumar Bag > Physical Science Dept. > IISC > -- Professor Laurence Marks "Research is to see what everybody else has seen, and to think what nobody else has thought", Albert Szent-Gyorgi www.numis.northwestern.edu ; Corrosion in 4D: MURI4D.numis.northwestern.edu Partner of the CFW 100% program for gender equity, www.cfw.org/100-percent Co-Editor, Acta Cryst A ___ Wien mailing list Wien@zeus.theochem.tuwien.ac.at http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien SEARCH the MAILING-LIST at: http://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at/index.html
[Wien] wien2k parallelization error
Dear wien2k experts, I got following error while running "x lapw1 -p" starting parallel lapw1 at Sun Aug 14 01:26:54 IST 2016 -> starting parallel LAPW1 jobs at Sun Aug 14 01:26:54 IST 2016 running LAPW1 in parallel mode (using .machines) *@: Expression Syntax.* 0.042u 0.838s 0:00.32 271.8%0+0k 0+0io 0pf+0w error: command /home/soumen/INSTALL-PACKAGES/wien2k_14_2_mpi/lapw1para lapw1.def failed my .machines file is granularity:1 1:compute-0-0:6 residue:compute-0-0:1 lapw0:compute-0-0:6 lapw1:compute-0-0:6 *Soumen Kumar Bag* *Physical Science Dept.* *IISC* ___ Wien mailing list Wien@zeus.theochem.tuwien.ac.at http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien SEARCH the MAILING-LIST at: http://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at/index.html
