[Pw_forum] Problems about QHA

GAO Zhe flux_ray12 at 163.com
Fri Apr 29 01:49:58 CEST 2011


There is two problems as I known.
First, gfortran cannot deal with the non-integer temperature step, so you would receive some warnings.
Second, try to ignore the compiling option '-static' in makefile, since both of ifort 2011 and gfortran is not seemed to support '-static' parameter.


At 2011-04-29 00:45:23,"zafar rasheed" <zafartariq2003 at yahoo.com> wrote:





Dear Eyvaz Isaev
 
We have just started use Quantum Espresso (since one years ago) . We want to calculat thermal properties (coefficient of thermal expansion, Cp, Cv etc.). But we can not create*.x  files of QHA folder. We are using Fedora core 7 (on Simple P4 computer having 2GHz processor , 256 RAM) having gfortran compiler. We change FC in Makefile ( ifort to gfortran) but*.x  files does not work. Please help us in this aspect. 
 
Best Regards
 
Zafar Rasheed
 
PhD Student
Department of Physics
 
The Islamia University of Bahawalpur, Pakistan
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