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[<xenophon.krokidis@scienomics.com>]

Dear All,

I am trying to perform a PAW calculation with the setup given below. However,
there is no any SCF step printed out and the calculation seems to run (several
wfoptalg values were tried such as 1, 11). Any ideas ?

Thank you in advance for the kind help. Xenophon

 nbdblock 6
 wfoptalg=1
 strprecon 0.1
 acell 5.0557 6.9684 6.1975 Angstr
 angdeg 90.1725 89.9883 55.884
 chkprim 0
 ecut 15 Hartree
 ecutsm 0.5 Hartree
 pawecutdg 45 Hartree
 ionmov 2
 ntime 200
 tolmxf 0.00005
 nkpt 0
 kptopt 1
 ngkpt 1 1 1
 nstep 50
 ixc 11
 nband  30
 nsppol 1
 natom 20
 nsym 1
 symrel 1 0 0  0 1 0  0 0 1
 ntypat 4
 occopt 1
 strtarget 0 0 0 0 0 0
 dilatmx 1.1
 optcell 2
 prtden 1
 toldff 0.000001
 typat 1 2 2 1 2 2 2 2 3 3 4 4 4 4 4 4 4 4 4 4
 xred 0.514506 0.517578 0.337544
 0.354529 0.65856 0.149121
 0.543363 0.523401 0.948735
 0.429453 0.418779 0.837167
 0.589942 0.278259 0.647364
 0.401054 0.412616 0.448164
 0.321035 0.887354 0.165817
 0.625195 0.0490203 0.661742
 0.792921 0.505765 0.898215
 0.152579 0.428644 0.397331
 0.722061 0.497055 0.381453
 0.220395 0.441001 0.880055
 0.819528 0.25585 0.644386
 0.554285 0.85897 0.171695
 0.192376 0.999226 0.0304452
 0.191765 0.978743 0.310754
 0.753587 0.958288 0.80614
 0.392761 0.076104 0.666813
 0.756119 0.937023 0.526133
 0.124522 0.681636 0.145734
 znucl 7 6 8 1