Please do cd $WIENROOT/SRC_mixer mv RegFixed.F RegFixed.F_old then cp the attached file to $WIENROOT/SRC_mixer/RegFixed.F and recompile. Let me know if this solves the problem, it might. If it does not then I will need to think more.
***** In addition, please find a sys_admin at your HFC and show them the contents of the file W2kutils.c and W2kutils.h. These are in SRC_mixer as well as SRC_lapw[0-2] and a few other places. For some reason the HPC system is not accepting the arguments. Unfortunately the location of C includes can vary, and it is hard to impossible to work this out from here. This is the reason for all the lines in seq-err.txt. If you are fluent in C you can probably work out what is appropriate for your HPC system. On Fri, Sep 23, 2016 at 1:43 PM, Paresh Chandra Rout < pareshchan...@iiserb.ac.in> wrote: > Hello Sir, > > Here, I have attached the SRC_mixer.tgz files . Yes, the *seq-err.txt * > is for the HPC. Also I typed ulimit on the terminal and it showed > *unlimited.* > > > > Kind Regards, > Paresh > > -- 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
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