Thank you Professor Blaha, I compiled it and found few errors;
1) In http://susi.theochem.tuwien.ac.at/reg_user/wien2k_download/ XCRYSDENS<http://www.xcrysden.org> => XCRYSDEN<http://www.xcrysden.org> 2) in siteconfig it says version 14.2 and date july/15 => version 16 and date december /16 3) I compiled it and found an error ---------- Compile time errors (if any) were: SRC_mixer/compile.msg:make: *** [RegGCV.f] Error 1 ---------- so I tried to see the file "compile.msg" and I did not find it I also tried to find it in other SRC directories with no exit. Saludos Pablo ________________________________ De: Wien <wien-boun...@zeus.theochem.tuwien.ac.at> en nombre de Peter Blaha <pbl...@theochem.tuwien.ac.at> Enviado: lunes, 12 de diciembre de 2016 12:07:22 p. m. Para: A Mailing list for WIEN2k users Asunto: [Wien] WIEN2k_16 Dear WIEN2k users, Finally, after a delay of almost one year, a new version is ready for distribution. WIEN2k_16 contains a lot of improvements and bug fixes and is a highly recommended, important update. lapw0: new meta-GGAs, the libxc-library and plotting of tau, .. lapw1: faster matrix routines (in real-sequential mode, in NMR-mode (all eigenvalues) and in mpi-parallel mode (ELPA). It supports now HDLOs (basis with d^2 u(r) / d^2 E) for better linearization (mainly for d- and f-atoms and large spheres) and together with a larger NLSMAX value (case.in1) you can use large atomic spheres without loss of accuracy. lapwso: bug-fixes in mpi version (non-squared processor grids) lapw2: support for multiple LOs and HDLOs, dmats in lapw2 hf: significant speedup (3 different modes for mpi-parallelization) mixer: new version x_nmr: Knight shift for metals, disk-space saving option BerryPI and wien2wannier: new versions various other changes, improved numerical stability (L.Marks), new scripts (Cgrace ...), support for SLURM (srun) queuing systems, ... ---------------------------------------------------------------- As usual, your wien2k-account is still valid for download of the new version at http://www.wien2k.at Peter Blaha -- -------------------------------------------------------------------------- Peter BLAHA, Inst.f. Materials Chemistry, TU Vienna, A-1060 Vienna Phone: +43-1-58801-165300 FAX: +43-1-58801-165982 Email: bl...@theochem.tuwien.ac.at WIEN2k: http://www.wien2k.at WWW: http://www.imc.tuwien.ac.at/staff/tc_group_e.php -------------------------------------------------------------------------- _______________________________________________ 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
_______________________________________________ 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