Currently you cannot use ESM together with FFT in the Intel MK library (DFTI). Use FFTW or FFTW3 instead
Paolo On Fri, Sep 16, 2016 at 10:08 PM, Nkosinathi Malaza <[email protected]> wrote: > Dear All, > > I am trying to run calculations using the ESM mode, the error message that > I get in the output file is: > > Error in routine esm_cft_1z_init (1): no scalar fft driver specified > > How can I resolve this? > > Thank you > > _______________________________________________ > Pw_forum mailing list > [email protected] > http://pwscf.org/mailman/listinfo/pw_forum > -- Paolo Giannozzi, Dip. Scienze Matematiche Informatiche e Fisiche, Univ. Udine, via delle Scienze 208, 33100 Udine, Italy Phone +39-0432-558216, fax +39-0432-558222
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