[CPMD-list] Empty ENERGIES file on x86-64 systems

[Alexandr Isayev]

Dear CPMD community.

I have experienced strange behavior of the code under AMD x86-64 architecture.
The file ENERGIES during *any* MD run always remains empty (0 bytes). Affected systems are
Opteron Linux cluster [cpmd v 3.9.2 compiled with pgi 6.1] and Cray XT3
[cpmd v 3.11.1 compiled with pgi 6.1.1 respectively]. I am also
checked the the reference energy values from cpmd-test distribution.
The values are correct.

Does anyone encountered something like that?

Thank you in advance,
Alexandr


  

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Alexandr Isayev,
Graduate Research Assistant, and System Administrator
@ Computational Center for Molecular Structure
and Interactions (CCMSI),
Jackson State University,
Jackson, MS USA
   Tel:  +(601) 979-1134
e-mail:  alex(at)ccmsi.us
   Web:  http://www.ccmsi.us
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