It is not necessary to include -c since the x script detects automatically if the calculation is complex.
On Monday 2016-11-07 17:28, Luis Ogando wrote:
Date: Mon, 7 Nov 2016 17:28:50 From: Luis Ogando <lcoda...@gmail.com> Reply-To: A Mailing list for WIEN2k users <wien@zeus.theochem.tuwien.ac.at> To: A Mailing list for WIEN2k users <wien@zeus.theochem.tuwien.ac.at> Subject: [Wien] run_lapw -hf (complex case) Dear Wien2k community, On page 51 of the User Guide (Wien2k 14.2) one can read the following sequence of commands corresponding to " run_lapw -hf " for the non-spin-polarized and real case: x lapw0 -grr (semilocal exchange) x lapw0 (semilocal exchange-correlation) x lapw1 (semilocal orbitals) x lapw2 (semilocal bands) mv case.vectorhf case.vectorhf_old x hf (hybrid orbitals) cp case.klist_fbz case.klist, cp case.kgen_fbz case.kgen x lapw2 -hf (hybrid electron density and bands) cp case.klist_ibz case.klist, cp case.kgen_ibz case.kgen x lcore x mixer I would like to know the correspondent sequence for the non-spin-polarized but complex case. It would be the same sequence but including " -c " when appropriate ? Thank you, Luis
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