[Pw_forum] Error with berry phase

swapnil chandratre swapnil.chandratre at gmail.com
Thu Jun 2 20:17:45 CEST 2011


Hi,

I receive the following error, when I run the nscf script after completing
the scf run.

# 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


Can anyone help me understand what the error hints at ?

-- 
Regards,
Swapnil Chandratre
Graduate Student
Dept. of Mechanical Engineering,
University of Houston,
Houston, TX
(M)-713-294-9546
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