<div dir="ltr"><div>Dear Prof. Blaha,</div><div><br></div><div> Yes, indeed the settings of fftw was not correct. Now, it has been corrected & wien2k has been installed successfully. Thanking you,<br></div><div><br></div><div>with regards<br></div></div><br><div class="gmail_quote"><div dir="ltr" class="gmail_attr">On Sun, 5 May 2024 at 00:51, Peter Blaha <<a href="mailto:peter.blaha@tuwien.ac.at">peter.blaha@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">Look into SRC_3ddens/compile.msg for more details.<br>
<br>
Since all these programs use fftw, I'd expect that your fftw settings <br>
are not correct or the library has been compiled with ifort, ...<br>
<br>
<br>
Am 04.05.2024 um 20:31 schrieb shamik chakrabarti:<br>
> Dear Wien2k users,<br>
> <br>
> While installing Wien2k -23 2 in Ubantu 22.04.4 <br>
> LTS, I got the following error<br>
> <br>
> Compile time errors (if any) were:<br>
> SRC_3ddens/compile.msg:collect2: error: ld returned 1 exit status<br>
> SRC_3ddens/compile.msg:make: *** [Makefile:65: 3ddens] Error 1<br>
> SRC_hf/compile.msg:collect2: error: ld returned 1 exit status<br>
> SRC_hf/compile.msg:make[1]: *** [Makefile:199: hf] Error 1<br>
> SRC_hf/compile.msg:make: *** [Makefile:181: real] Error 2<br>
> SRC_hf/compile.msg:collect2: error: ld returned 1 exit status<br>
> SRC_hf/compile.msg:make[1]: *** [Makefile:202: hfc] Error 1<br>
> SRC_hf/compile.msg:make: *** [Makefile:185: complex] Error 2<br>
> SRC_lapw0/compile.msg:collect2: error: ld returned 1 exit status<br>
> SRC_lapw0/compile.msg:make[1]: *** [Makefile:136: lapw0] Error 1<br>
> SRC_lapw0/compile.msg:make: *** [Makefile:125: seq] Error 2<br>
> SRC_lapw2/compile.msg:collect2: error: ld returned 1 exit status<br>
> SRC_lapw2/compile.msg:make[1]: *** [Makefile:187: lapw2] Error 1<br>
> SRC_lapw2/compile.msg:make: *** [Makefile:169: real] Error 2<br>
> SRC_lapw2/compile.msg:collect2: error: ld returned 1 exit status<br>
> SRC_lapw2/compile.msg:make[1]: *** [Makefile:190: lapw2c] Error 1<br>
> SRC_lapw2/compile.msg:make: *** [Makefile:173: complex] Error 2<br>
> SRC_nlvdw/compile.msg:collect2: error: ld returned 1 exit status<br>
> SRC_nlvdw/compile.msg:make[1]: *** [Makefile:119: nlvdw] Error 1<br>
> SRC_nlvdw/compile.msg:make: *** [Makefile:110: seq] Error 2<br>
> SRC_nmr/compile.msg:collect2: error: ld returned 1 exit status<br>
> SRC_nmr/compile.msg:make[1]: *** [Makefile:181: nmr] Error 1<br>
> SRC_nmr/compile.msg:make: *** [Makefile:163: real] Error 2<br>
> SRC_nmr/compile.msg:collect2: error: ld returned 1 exit status<br>
> SRC_nmr/compile.msg:make[1]: *** [Makefile:184: nmrc] Error 1<br>
> SRC_nmr/compile.msg:make: *** [Makefile:167: complex] Error 2<br>
> <br>
> The Options are<br>
> <br>
> Current settings:<br>
> M OpenMP switch: -fopenmp<br>
> O Compiler options: -ffree-form -O2 -ftree-vectorize <br>
> -march=native -ffree-line-length-none -ffpe-summary=none<br>
> L Linker Flags: $(FOPT) -L../SRC_lib<br>
> P Preprocessor flags '-DParallel'<br>
> R R_LIBS (LAPACK+BLAS): -L/home/shamik/OpenBLAS-0.3.26 <br>
> -lopenblas -lpthread<br>
> F FFTW options: -DFFTW3 -I/home/shamik/fftw-3.3.10/include<br>
> FFTW-LIBS: -L/home/shamik/fftw-3.3.10/lib -lfftw-3.3.10<br>
> X LIBX options: -DLIBXC -I/home/shamik/libxc-6.2.2/include<br>
> LIBXC-LIBS: -L/home/shamik/libxc-6.2.2/lib -lxcf03 -lxc<br>
> <br>
> Please suggest.<br>
> <br>
> <br>
> <br>
> <br>
> -- <br>
> Dr. Shamik Chakrabarti<br>
> Research Fellow<br>
> Department of Physics<br>
> Indian Institute of Technology Patna<br>
> Bihta-801103<br>
> Patna<br>
> Bihar, India<br>
> <br>
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<br>
-- <br>
--------------------------------------------------------------------------<br>
Peter BLAHA, Inst.f. Materials Chemistry, TU Vienna, A-1060 Vienna<br>
Phone: +43-1-58801-165300<br>
Email: <a href="mailto:peter.blaha@tuwien.ac.at" target="_blank">peter.blaha@tuwien.ac.at</a> WIEN2k: <a href="http://www.wien2k.at" rel="noreferrer" target="_blank">http://www.wien2k.at</a><br>
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</blockquote></div><br clear="all"><br><span class="gmail_signature_prefix">-- </span><br><div dir="ltr" class="gmail_signature"><div dir="ltr"><div><div dir="ltr"><div dir="ltr"><div dir="ltr"><div dir="ltr"><div style="font-size:small">Dr. Shamik Chakrabarti</div><div style="font-size:small">Research Fellow </div><div style="font-size:small">Department of Physics</div><div style="font-size:small">Indian Institute of Technology Patna</div><div style="font-size:small">Bihta-801103</div><div style="font-size:small">Patna</div><div style="font-size:small">Bihar, India</div></div></div></div></div></div></div></div>