Hello, this is what I have: $MKLROOT variable got hurt to "KLROOT" and I need to find the corresponding text file... . . SRC_vecpratt/vecpratt SRC_vecpratt/vecprattc SRC_w2w/w2w SRC_w2w/w2wc SRC_w2web/w2web cp: âSRC_w2web/w2webâ and â/lustre/home/ilias/work/qch/software/wien2k/WIEN2k_23.2_intelmklserial/w2webâ are the same file SRC_wplot/wplot SRC_wplot/wplotc WARNING: no executable found in SRC_structeditor/SRC_ncmsymmetry. Check compile.msg in this directory SRC_structeditor/SRC_readwrite/readwrite SRC_structeditor/SRC_struct2mol/struct2mol SRC_structeditor/SRC_structgen/structgen
done. Compile time errors (if any) were: SRC_afmsim/compile.msg:ifort: error #10236: File not found: 'KLROOT/lib/intel64/libmkl_blas95_lp64.a' SRC_afmsim/compile.msg:ifort: error #10236: File not found: 'KLROOT/lib/intel64/libmkl_lapack95_lp64.a' SRC_afmsim/compile.msg:make: *** [afmsim] Error 1 SRC_aim/compile.msg:ifort: error #10236: File not found: 'KLROOT/lib/intel64/libmkl_blas95_lp64.a' SRC_aim/compile.msg:ifort: error #10236: File not found: 'KLROOT/lib/intel64/libmkl_lapack95_lp64.a' SRC_aim/compile.msg:make[1]: *** [aim] Error 1 SRC_aim/compile.msg:make: *** [real] Error 2 SRC_aim/compile.msg:ifort: error #10236: File not found: 'KLROOT/lib/intel64/libmkl_blas95_lp64.a' SRC_aim/compile.msg:ifort: error #10236: File not found: 'KLROOT/lib/intel64/libmkl_lapack95_lp64.a' SRC_aim/compile.msg:make[1]: *** [aimc] Error 1 SRC_aim/compile.msg:make: *** [complex] Error 2 SRC_clminter/compile.msg:ifort: error #10236: File not found: 'KLROOT/lib/intel64/libmkl_blas95_lp64.a' SRC_clminter/compile.msg:ifort: error #10236: File not found: 'KLROOT/lib/intel64/libmkl_lapack95_lp64.a' SRC_clminter/compile.msg:make: *** [clminter] Error 1 SRC_dipan/compile.msg:ifort: error #10236: File not found: 'KLROOT/lib/intel64/libmkl_blas95_lp64.a' SRC_dipan/compile.msg:ifort: error #10236: File not found: 'KLROOT/lib/intel64/libmkl_lapack95_lp64.a' SRC_dipan/compile.msg:make: *** [dipan] Error 1 SRC_dstart/compile.msg:ifort: error #10236: File not found: 'KLROOT/lib/intel64/libmkl_blas95_lp64.a' SRC_dstart/compile.msg:ifort: error #10236: File not found: 'KLROOT/lib/intel64/libmkl_lapack95_lp64.a' SRC_dstart/compile.msg:make[1]: *** [dstart] Error 1 SRC_dstart/compile.msg:make: *** [seq] Error 2 SRC_eosfit6/compile.msg:ifort: error #10236: File not found: 'KLROOT/lib/intel64/libmkl_blas95_lp64.a' SRC_eosfit6/compile.msg:ifort: error #10236: File not found: 'KLROOT/lib/intel64/libmkl_lapack95_lp64.a' SRC_eosfit6/compile.msg:make: *** [eosfit6] Error 1 SRC_filtvec/compile.msg:ifort: error #10236: File not found: 'KLROOT/lib/intel64/libmkl_blas95_lp64.a' SRC_filtvec/compile.msg:ifort: error #10236: File not found: 'KLROOT/lib/intel64/libmkl_lapack95_lp64.a' SRC_filtvec/compile.msg:make[1]: *** [filtvec] Error 1 SRC_filtvec/compile.msg:make: *** [real] Error 2 SRC_filtvec/compile.msg:ifort: error #10236: File not found: 'KLROOT/lib/intel64/libmkl_blas95_lp64.a' SRC_filtvec/compile.msg:ifort: error #10236: File not found: 'KLROOT/lib/intel64/libmkl_lapack95_lp64.a' SRC_filtvec/compile.msg:make[1]: *** [filtvecc] Error 1 SRC_filtvec/compile.msg:make: *** [complex] Error 2 SRC_hf/compile.msg:ifort: error #10236: File not found: 'KLROOT/lib/intel64/libmkl_blas95_lp64.a' SRC_hf/compile.msg:ifort: error #10236: File not found: 'KLROOT/lib/intel64/libmkl_lapack95_lp64.a' SRC_hf/compile.msg:make[1]: *** [hf] Error 1 SRC_hf/compile.msg:make: *** [real] Error 2 SRC_hf/compile.msg:ifort: error #10236: File not found: 'KLROOT/lib/intel64/libmkl_blas95_lp64.a' SRC_hf/compile.msg:ifort: error #10236: File not found: 'KLROOT/lib/intel64/libmkl_lapack95_lp64.a' SRC_hf/compile.msg:make[1]: *** [hfc] Error 1 SRC_hf/compile.msg:make: *** [complex] Error 2 SRC_IRelast/compile.msg:ifort: error #10236: File not found: 'KLROOT/lib/intel64/libmkl_blas95_lp64.a' SRC_IRelast/compile.msg:ifort: error #10236: File not found: 'KLROOT/lib/intel64/libmkl_lapack95_lp64.a' SRC_IRelast/compile.msg:make: *** [../setupc] Error 1 SRC_lapw0/compile.msg:ifort: error #10236: File not found: 'KLROOT/lib/intel64/libmkl_blas95_lp64.a' SRC_lapw0/compile.msg:ifort: error #10236: File not found: 'KLROOT/lib/intel64/libmkl_lapack95_lp64.a' SRC_lapw0/compile.msg:make[1]: *** [lapw0] Error 1 SRC_lapw0/compile.msg:make: *** [seq] Error 2 SRC_lapw1/compile.msg:ifort: error #10236: File not found: 'KLROOT/lib/intel64/libmkl_blas95_lp64.a' SRC_lapw1/compile.msg:ifort: error #10236: File not found: 'KLROOT/lib/intel64/libmkl_lapack95_lp64.a' SRC_lapw1/compile.msg:make[1]: *** [lapw1] Error 1 SRC_lapw1/compile.msg:make: *** [real] Error 2 SRC_lapw1/compile.msg:ifort: error #10236: File not found: 'KLROOT/lib/intel64/libmkl_blas95_lp64.a' SRC_lapw1/compile.msg:ifort: error #10236: File not found: 'KLROOT/lib/intel64/libmkl_lapack95_lp64.a' SRC_lapw1/compile.msg:make[1]: *** [lapw1c] Error 1 SRC_lapw1/compile.msg:make: *** [complex] Error 2 SRC_lapw2/compile.msg:ifort: error #10236: File not found: 'KLROOT/lib/intel64/libmkl_blas95_lp64.a' SRC_lapw2/compile.msg:ifort: error #10236: File not found: 'KLROOT/lib/intel64/libmkl_lapack95_lp64.a' SRC_lapw2/compile.msg:make[1]: *** [lapw2] Error 1 SRC_lapw2/compile.msg:make: *** [real] Error 2 SRC_lapw2/compile.msg:ifort: error #10236: File not found: 'KLROOT/lib/intel64/libmkl_blas95_lp64.a' SRC_lapw2/compile.msg:ifort: error #10236: File not found: 'KLROOT/lib/intel64/libmkl_lapack95_lp64.a' SRC_lapw2/compile.msg:make[1]: *** [lapw2c] Error 1 SRC_lapw2/compile.msg:make: *** [complex] Error 2 SRC_lapw5/compile.msg:ifort: error #10236: File not found: 'KLROOT/lib/intel64/libmkl_blas95_lp64.a' SRC_lapw5/compile.msg:ifort: error #10236: File not found: 'KLROOT/lib/intel64/libmkl_lapack95_lp64.a' SRC_lapw5/compile.msg:make[1]: *** [lapw5] Error 1 SRC_lapw5/compile.msg:make: *** [real] Error 2 SRC_lapw5/compile.msg:ifort: error #10236: File not found: 'KLROOT/lib/intel64/libmkl_blas95_lp64.a' SRC_lapw5/compile.msg:ifort: error #10236: File not found: 'KLROOT/lib/intel64/libmkl_lapack95_lp64.a' SRC_lapw5/compile.msg:make[1]: *** [lapw5c] Error 1 SRC_lapw5/compile.msg:make: *** [complex] Error 2 SRC_lapw7/compile.msg:ifort: error #10236: File not found: 'KLROOT/lib/intel64/libmkl_blas95_lp64.a' SRC_lapw7/compile.msg:ifort: error #10236: File not found: 'KLROOT/lib/intel64/libmkl_lapack95_lp64.a' SRC_lapw7/compile.msg:make[1]: *** [lapw7] Error 1 SRC_lapw7/compile.msg:make: *** [real] Error 2 SRC_lapwdm/compile.msg:ifort: error #10236: File not found: 'KLROOT/lib/intel64/libmkl_blas95_lp64.a' SRC_lapwdm/compile.msg:ifort: error #10236: File not found: 'KLROOT/lib/intel64/libmkl_lapack95_lp64.a' SRC_lapwdm/compile.msg:make[1]: *** [lapwdm] Error 1 SRC_lapwdm/compile.msg:make: *** [real] Error 2 SRC_lapwdm/compile.msg:ifort: error #10236: File not found: 'KLROOT/lib/intel64/libmkl_blas95_lp64.a' SRC_lapwdm/compile.msg:ifort: error #10236: File not found: 'KLROOT/lib/intel64/libmkl_lapack95_lp64.a' SRC_lapwdm/compile.msg:make[1]: *** [lapwdmc] Error 1 SRC_lapwdm/compile.msg:make: *** [complex] Error 2 SRC_lapwso/compile.msg:ifort: error #10236: File not found: 'KLROOT/lib/intel64/libmkl_blas95_lp64.a' SRC_lapwso/compile.msg:ifort: error #10236: File not found: 'KLROOT/lib/intel64/libmkl_lapack95_lp64.a' SRC_lapwso/compile.msg:make[1]: *** [lapwso] Error 1 SRC_lapwso/compile.msg:make: *** [seq] Error 2 SRC_lcore/compile.msg:ifort: error #10236: File not found: 'KLROOT/lib/intel64/libmkl_blas95_lp64.a' SRC_lcore/compile.msg:ifort: error #10236: File not found: 'KLROOT/lib/intel64/libmkl_lapack95_lp64.a' SRC_lcore/compile.msg:make: *** [lcore] Error 1 SRC_mini/compile.msg:ifort: error #10236: File not found: 'KLROOT/lib/intel64/libmkl_blas95_lp64.a' SRC_mini/compile.msg:ifort: error #10236: File not found: 'KLROOT/lib/intel64/libmkl_lapack95_lp64.a' SRC_mini/compile.msg:make: *** [mini] Error 1 SRC_mixer/compile.msg:ifort: error #10236: File not found: 'KLROOT/lib/intel64/libmkl_blas95_lp64.a' SRC_mixer/compile.msg:ifort: error #10236: File not found: 'KLROOT/lib/intel64/libmkl_lapack95_lp64.a' SRC_mixer/compile.msg:make: *** [mixer] Error 1 SRC_mstar/compile.msg:ifort: error #10236: File not found: 'KLROOT/lib/intel64/libmkl_blas95_lp64.a' SRC_mstar/compile.msg:ifort: error #10236: File not found: 'KLROOT/lib/intel64/libmkl_lapack95_lp64.a' SRC_mstar/compile.msg:make: *** [mstar] Error 1 SRC_nlvdw/compile.msg:ifort: error #10236: File not found: 'KLROOT/lib/intel64/libmkl_blas95_lp64.a' SRC_nlvdw/compile.msg:ifort: error #10236: File not found: 'KLROOT/lib/intel64/libmkl_lapack95_lp64.a' SRC_nlvdw/compile.msg:make[1]: *** [nlvdw] Error 1 SRC_nlvdw/compile.msg:make: *** [seq] Error 2 SRC_nmr/compile.msg:ifort: error #10236: File not found: 'KLROOT/lib/intel64/libmkl_blas95_lp64.a' SRC_nmr/compile.msg:ifort: error #10236: File not found: 'KLROOT/lib/intel64/libmkl_lapack95_lp64.a' SRC_nmr/compile.msg:make[1]: *** [nmr] Error 1 SRC_nmr/compile.msg:make: *** [real] Error 2 SRC_nmr/compile.msg:ifort: error #10236: File not found: 'KLROOT/lib/intel64/libmkl_blas95_lp64.a' SRC_nmr/compile.msg:ifort: error #10236: File not found: 'KLROOT/lib/intel64/libmkl_lapack95_lp64.a' SRC_nmr/compile.msg:make[1]: *** [nmrc] Error 1 SRC_nmr/compile.msg:make: *** [complex] Error 2 SRC_pairhess/compile.msg:ifort: error #10236: File not found: 'KLROOT/lib/intel64/libmkl_blas95_lp64.a' SRC_pairhess/compile.msg:ifort: error #10236: File not found: 'KLROOT/lib/intel64/libmkl_lapack95_lp64.a' SRC_pairhess/compile.msg:make: *** [pairhess] Error 1 SRC_qtl/compile.msg:ifort: error #10236: File not found: 'KLROOT/lib/intel64/libmkl_blas95_lp64.a' SRC_qtl/compile.msg:ifort: error #10236: File not found: 'KLROOT/lib/intel64/libmkl_lapack95_lp64.a' SRC_qtl/compile.msg:make: *** [qtl] Error 1 SRC_structeditor/compile.msg:ifort: error #10236: File not found: 'KLROOT/lib/intel64/libmkl_blas95_lp64.a' SRC_structeditor/compile.msg:ifort: error #10236: File not found: 'KLROOT/lib/intel64/libmkl_lapack95_lp64.a' SRC_structeditor/compile.msg:make[1]: *** [ncmsymmetry] Error 1 SRC_structeditor/compile.msg:make: *** [all] Error 2 SRC_sumpara/compile.msg:ifort: error #10236: File not found: 'KLROOT/lib/intel64/libmkl_blas95_lp64.a' SRC_sumpara/compile.msg:ifort: error #10236: File not found: 'KLROOT/lib/intel64/libmkl_lapack95_lp64.a' SRC_sumpara/compile.msg:make: *** [sumpara] Error 1 SRC_vecpratt/compile.msg:ifort: error #10236: File not found: 'KLROOT/lib/intel64/libmkl_blas95_lp64.a' SRC_vecpratt/compile.msg:ifort: error #10236: File not found: 'KLROOT/lib/intel64/libmkl_lapack95_lp64.a' SRC_vecpratt/compile.msg:make[1]: *** [vecpratt] Error 1 SRC_vecpratt/compile.msg:make: *** [real] Error 2 SRC_vecpratt/compile.msg:ifort: error #10236: File not found: 'KLROOT/lib/intel64/libmkl_blas95_lp64.a' SRC_vecpratt/compile.msg:ifort: error #10236: File not found: 'KLROOT/lib/intel64/libmkl_lapack95_lp64.a' SRC_vecpratt/compile.msg:make[1]: *** [vecprattc] Error 1 SRC_vecpratt/compile.msg:make: *** [complex] Error 2 SRC_w2w/compile.msg:ifort: error #10236: File not found: 'KLROOT/lib/intel64/libmkl_blas95_lp64.a' SRC_w2w/compile.msg:ifort: error #10236: File not found: 'KLROOT/lib/intel64/libmkl_lapack95_lp64.a' SRC_w2w/compile.msg:make: *** [w2w] Error 1 SRC_w2w/compile.msg:ifort: error #10236: File not found: 'KLROOT/lib/intel64/libmkl_blas95_lp64.a' SRC_w2w/compile.msg:ifort: error #10236: File not found: 'KLROOT/lib/intel64/libmkl_lapack95_lp64.a' SRC_w2w/compile.msg:make: *** [w2wc] Error 1 SRC_wplot/compile.msg:ifort: error #10236: File not found: 'KLROOT/lib/intel64/libmkl_blas95_lp64.a' SRC_wplot/compile.msg:ifort: error #10236: File not found: 'KLROOT/lib/intel64/libmkl_lapack95_lp64.a' SRC_wplot/compile.msg:make: *** [wplot] Error 1 SRC_wplot/compile.msg:ifort: error #10236: File not found: 'KLROOT/lib/intel64/libmkl_blas95_lp64.a' SRC_wplot/compile.msg:ifort: error #10236: File not found: 'KLROOT/lib/intel64/libmkl_lapack95_lp64.a' SRC_wplot/compile.msg:make: *** [wplotc] Error 1 SRC_structeditor/SRC_ncmsymmetry/compile.msg:ifort: error #10236: File not found: 'KLROOT/lib/intel64/libmkl_blas95_lp64.a' SRC_structeditor/SRC_ncmsymmetry/compile.msg:ifort: error #10236: File not found: 'KLROOT/lib/intel64/libmkl_lapack95_lp64.a' SRC_structeditor/SRC_ncmsymmetry/compile.msg:make: *** [ncmsymmetry] Error 1 Check file compile.msg in the corresponding SRC_* directory for the compilation log and more info on any compilation problem. Press RETURN to continue -- ________________________________ From: Ilias Miroslav, doc. RNDr., PhD. Sent: Sunday, May 28, 2023 17:57 To: wien@zeus.theochem.tuwien.ac.at <wien@zeus.theochem.tuwien.ac.at> Subject: relinking the code, keeping compiled object files Hello, after lenghty compilation of Wien2k the linking step crashed. It there a quick way just to fix the linking command and relink the code for getting final executables ? Wien2k setup offers only recompilation of the whole bunch, without checking if files were previously compiled. Best, Miro ________________________________ From: Ilias Miroslav, doc. RNDr., PhD. Sent: Sunday, May 28, 2023 17:57 To: wien@zeus.theochem.tuwien.ac.at <wien@zeus.theochem.tuwien.ac.at> Subject: relinking the code, keeping compiled object files Hello, after lenghty compilation of Wien2k the linking step crashed. It there a quick way just to fix the linking command and relink the code for getting final executables ? Wien2k setup offers only recompilation of the whole bunch, without checking if files were previously compiled. Best, Miro
_______________________________________________ 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