[QE-users] 2. k-point parallelisation using ESM-RISM: seg fault (Tom Demeyere)

[Robinson Juma Musembi]

items in quote marks are interpreted as data type string by the computer,
the error might be triggered by how you have written the prefix
&CONTROL
   calculation      = 'relax'
   restart_mode     = 'from_scratch'
   nstep            = 999
   tstress          = .false.
   tprnfor          = .true.
   outdir           = 'pw.dir'
   prefix           = ?pw'
   etot_conv_thr    = 1e-06
   forc_conv_thr    = 0.001
   trism            = .true.
/

*Robinson J.  Musembi*
Solid State and Materials Research
Department of Physics, University of Nairobi

-- 
-----------------------------------------
A KEBS 9001:2015 Certified 
Organization, No. KEBS/QMS/RF:064 Rev. 03



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