[Pw_forum] Error while trying to calculate phonons on a grid

Gabriele Sclauzero gabriele.sclauzero at epfl.ch
Fri Jan 11 10:03:28 CET 2013


Are you using the same version of pw.x and ph.x? In the latest version, the code writes and reads the parameter U_PROJECTION_TYPE to the data-file, but previous versions. If you use pw and ph from the same distribution, I think you should not find this problem anyway. Let me know if this is not the case.

HTH

GS

> Dear All 
> I am trying to perform phonon calculations for NiO. But each time I try to run the first step of the process I get the following error:
> 
> ########################################################################################################################
> # FROM IOTK LIBRARY, VERSION 1.2.0
> # UNRECOVERABLE ERROR (ierr=-1)
> # ERROR IN: iotk_scan_dat (iotk_dat+CHARACTER1_0.f90:546)
> # CVS Revision: 1.27
> # Dat not found
> name=U_PROJECTION_TYPE
> ########################################################################################################################


§ Gabriele Sclauzero, EPFL SB ITP CSEA
   PH H2 462, Station 3, CH-1015 Lausanne







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