[Pw_forum] Error in ph.out
mayank gupta
mayankaditya at gmail.com
Wed Aug 25 13:54:19 CEST 2010
Dear all QE user
I am running my phonon caclculation on parallel machine using 8
processors and there is some error meassage in betwwen the zro.ph.out
file. I am a new user. please tell me the possible error in my input
file. the error message is :
Message from routine mix_potential:
file not found, restarting
iter # 1 total cpu time : 37578.8 secs av.it.: 15.3
thresh= 0.317E-06 alpha_mix = 0.700 |ddv_scf|^2 = 0.537E-11
iter # 7 total cpu time : 37778.2 secs av.it.: 15.1
thresh= 0.429E-06 alpha_mix = 0.700 |ddv_scf|^2 = 0.568E-12
End of electric fields calculation
Dielectric constant in cartesian axis
( 4.934251272 0.100380641 0.000000000 )
( 0.099903993 5.367494421 0.000000000 )
( 0.000000000 0.000000000 5.372792300 )
Message from routine mix_potential:
file not found, restarting
iter # 1 total cpu time : 38083.2 secs av.it.: 16.0
thresh= 0.277E-06 alpha_mix = 0.700 |ddv_scf|^2 = 0.916E-11
%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
from davcio : error # 99
error while reading from file
%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
stopping ...
%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
from davcio : error # 99
error while reading from file
%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
stopping ...
More information about the users
mailing list