Dear all, My goal is to calculate the electron phonon coupling (lambda) for a system. In the guide it says that using lambda.x with dos=.true. will produce phonon DOS and output the value of lambda. However when I apply matdyn.x with dos=.true. and la2F=.true.,the calculations start but then the code stops with the error (without outputting the value of lambda!) "Max |d(i,j)-d*(j,i)|/|d(i,j)|: ********% Max |d(i,j)-d*(j,i)| = 0.004615 Max |d(i,j)-d*(j,i)|/|d(i,j)|: ********% Max |d(i,j)-d*(j,i)| = 0.004615 Max |d(i,j)-d*(j,i)|/|d(i,j)|: ********%rank 0 in job 1 veredas44_36139 caused collective abort of all ranks exit status of rank 0: killed by signal 9" Is that error related to the input of the matdyn file or is it due to something else? I use espresso 5.0.1 and the input of the matdyn file is: &input asr='simple', dos=.true., la2F=.true., amass(1)=12.0107, flfrc='elphag2ga.fc', flfrq='elphag2ga.freq', fldos='elphag2ga.phdos', nk1=120 nk2=120 nk3=1, ndos=100 / Thanks in advance -------------- next part -------------- An HTML attachment was scrubbed... URL: http://pwscf.org/pipermail/pw_forum/attachments/20140317/6cad3cc6/attachment.html
