Re: [Wien] Error in Commandline: x lapw1 -band

That w2web error with gfortran is due to bugs in the band.pl and scf.pl files.  You need to apply the fixed files given in the mailing list archive [ http://zeus.theochem.tuwien.ac.at/pipermail/wien/2017-July/026651.html ,

[Wien] Error in Commandline: x lapw1 -band

During execution of band structure task at command x lapw1 -band i am getting following message Commandline: *x lapw1 -band * Program input is: *""* At line 75 of file modules_tmp_.F (unit = 5, file = 'root.in1c') Fortran runtime error: End of file 0.003u 0.000s 0:00.00 0.0% 0+0k 0+0io

[Wien] SO in 3d and 4f elements

Dear WIEN2k community, I know that spin-orbit coupling in 4d and 5d is important, but how important is SOC for 3d and 4f elements? Yours Pablo de la Mora ___ Wien mailing list Wien@zeus.theochem.tuwien.ac.at

Re: [Wien] To install WIEN2k

Dear Sir, Thank you very much for your suggestions sir and definitely, i will follow accordingly and get success. On Sun, Mar 11, 2018 at 5:29 AM, Gavin Abo wrote: > Below steps on a WIEN2k install (using gfortran/cc, Ubuntu, OpenBLAS): > > ubuntu@ubuntu:~$ lsb_release -a