[Pw_forum] the vcsmd.f90

wangqj1 wangqj1 at 126.com
Mon Nov 17 13:52:40 CET 2008


 
 Dear all
      After I installed the espresso-4.0.3,I use pw.x to do vc-relax,but it turned up as following and stoped:
 
    total   stress  (Ry/bohr**3)                   (kbar)     P=   43.49
   0.00029630   0.00000000   0.00000000         43.59      0.00      0.00
   0.00000000   0.00029630   0.00000000          0.00     43.59      0.00
   0.00000000   0.00000000   0.00029429          0.00      0.00     43.29
At line 151 of file vcsmd.f90
Fortran runtime error: Bad real number in item 33 of list input
 
   I don't know what's wrong , I installed Federo core 8 which bring fortran95 compiler of itself . What should I do ?
   Any help will be appreciated !
Q J Wang
   
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