Hello PWSCF users, I have installed espresso-4.1 version in parallel
Machine complier AIX-IBM mpxlf95 and mpicc Linux ifort and icc I am doing a relax calculation of LaMnO3, the linux doing Entering Dynamics: iteration =2 while the AIX-IBM is doing Entering Dynamics: iteration =12 Can any body suggest why it is happening? I am attaching the two make.sys files -- Dr. Bipul Rakshit Research Associate, S N Bose Centre for Basic Sciences, Salt Lake, Kolkata 700 098 India -------------- next part -------------- An HTML attachment was scrubbed... URL: http://www.democritos.it/pipermail/pw_forum/attachments/20090805/9ad42481/attachment-0001.htm -------------- next part -------------- A non-text attachment was scrubbed... Name: make.sys-IBM Type: application/octet-stream Size: 4996 bytes Desc: not available Url : http://www.democritos.it/pipermail/pw_forum/attachments/20090805/9ad42481/attachment-0002.obj -------------- next part -------------- A non-text attachment was scrubbed... Name: make.sys-Linux Type: application/octet-stream Size: 4661 bytes Desc: not available Url : http://www.democritos.it/pipermail/pw_forum/attachments/20090805/9ad42481/attachment-0003.obj