<div dir="ltr">Hi Laurence,<div><br></div><div>Thank you for your response, the gfortran route sounds promising. When I run ./siteconfig_lapw, I do select the LG gfortran+gcc+OpenBlas option and, on the following prompts, I do set the compilers to gfortran and gcc, which led to the errors I posted. Do I need to manually change to gfortran via a text editor and, if so, do I need to modify siteconfig or siteconfig_lapw?</div><div><br></div><div>Thank you,</div><div>Brandon</div></div><br><div class="gmail_quote"><div dir="ltr" class="gmail_attr">On Fri, Jun 2, 2023 at 1:51 PM Laurence Marks <<a href="mailto:laurence.marks@gmail.com">laurence.marks@gmail.com</a>> wrote:<br></div><blockquote class="gmail_quote" style="margin:0px 0px 0px 0.8ex;border-left:1px solid rgb(204,204,204);padding-left:1ex"><div dir="ltr"><div dir="ltr"><div class="gmail_default" style="font-family:verdana,sans-serif;color:rgb(0,0,0)">Your last problem is easy: you need to change in site_config to use gfortran, as all the compiler options are different.</div><div class="gmail_default" style="font-family:verdana,sans-serif;color:rgb(0,0,0)"><br></div><div class="gmail_default" style="font-family:verdana,sans-serif;color:rgb(0,0,0)">It is hard to know exactly what the earlier issues are, beyond that your PATH variable is being messed up. All I wonder is whether $MKLPATH, $MKLROOT etc were properly sourced/set before you run site_config, they probably were not. For certain this is not a Wien2k problem, it is something in your OS/configuration, sorry.</div></div><br><div class="gmail_quote"><div dir="ltr" class="gmail_attr">On Fri, Jun 2, 2023 at 3:25 PM Brandon Gunn via Wien <<a href="mailto:wien@zeus.theochem.tuwien.ac.at" target="_blank">wien@zeus.theochem.tuwien.ac.at</a>> wrote:<br></div><blockquote class="gmail_quote" style="margin:0px 0px 0px 0.8ex;border-left:1px solid rgb(204,204,204);padding-left:1ex"><div dir="ltr">Also, if I try to install using gfortran + gcc, it gives errors like this when compiling:<div><br></div><div>rm  -f *.o *.list *.prj ../libblas_lapw.a<br>gfortran -c  -O -FR -mp1 -w -prec_div -pc80 -pad -ip -DINTEL_VML -traceback -assume buffered_io -I/include blas_lapw1.f<br>gfortran: error: unrecognized command-line option ‘-assume’<br>make: *** [Makefile:86: ../libblas_lapw.a(blas_lapw1.o)] Error 1<br></div></div>
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</blockquote></div><br clear="all"><div><br></div><span class="gmail_signature_prefix">-- </span><br><div dir="ltr" class="gmail_signature"><div dir="ltr">Professor Laurence Marks (Laurie)<br>Department of Materials Science and Engineering<br>Northwestern University<br><a href="https://urldefense.com/v3/__http://www.numis.northwestern.edu__;!!Mih3wA!CNA_Bpvs9ius9V9Ydz9_FfKT1DxKPyF7x1TmakjKJvxSdSccuf4hLxf6-8_WQiy46Osj3lk3mTIJGbKhzL0efSw$" target="_blank">www.numis.northwestern.edu</a><br>"Research is to see what everybody else has seen, and to think what nobody else has thought", Albert Szent-Györgyi</div></div></div>
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