Dear All,
I compiled the latest version of pwscf (4.2.1) on IBM Power5 machine (xlf
compiler) as well as on Dell Cluster (Intel ifort 11.1.056). In both cases,
calculation including EXX (PBE0) fails on 1D supercell. However, the same job
ran without dumping the core with pwscf 4.1.3. Any suggestion ? I would like to
use the latest version as it supports restarting the EXX calculation.
Thank you
- Madan
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Madan Mithra .L.M
Senior Research Fellow
Dept.of Physics
Indian Institute of Science
Bangalore - 560 012
INDIA
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e-mail : mit at physics.iisc.ernet.in
: snd2mra at yahoo.com
Phone : 91-80-22932313 (Lab)
FAX : (080) 360 2602
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