Hi,
I got the following error when I used dos.x bundled with QE vs. 4.3.1
to try to obtain the dos for a nanowire. I don't think I am doing
anything wrong since dos.x from QE vs. 4.2 works but you never can
tell, so pls let me know if my input is in error. The scf was always
performed with pw.x in QE vs. 4.3.1:
########################################################################################################################
# FROM IOTK LIBRARY, VERSION 1.2.0
# UNRECOVERABLE ERROR (ierr=-1)
# ERROR IN: iotk_scan_dat (iotk_dat.spp:1002)
# CVS Revision: 1.27
# Dat not found
name=NON-PERIODIC_CELL_CORRECTION
########################################################################################################################
ERROR: 0031-250 task 0: Terminated
ERROR: 0031-250 task 1: Terminated
My input (dos.in):
&INPUTPP
prefix='nt12',
outdir = './SCRATCH/',
fildos='mydos.dat'
Emin=-25.0,
Emax=5.0,
DeltaE=0.00350
degauss=0.0036764705882352945
/
Grazie!
o.
Omololu AKIN-OJO
Postdoctoral Fellow,
International Centre for Theoretical Physics (ICTP)
Trieste, Italy.
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