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Writing checkpoint file
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Writing model to PhonDOS.check
Error in PHONON_LINEAR_RESPONSE.  DFPT convergence failed - aborting
Current trace stack:
phonon_linear_response
phonon_dynamical_matrix
phonon_calculate_std_kpoints
phonon_calculate
castep
OMP: Warning #2: Cannot open message catalog "2052\libiomp5ui.dll":
OMP: System error #126: ÕÒ²»µ½Ö¸¶¨µÄÄ£¿é¡£
OMP: Info #3: Default messages will be used.
OMP: Warning #2: Cannot open message catalog "2052\libiomp5ui.dll":
OMP: System error #126: ÕÒ²»µ½Ö¸¶¨µÄÄ£¿é¡£
OMP: Info #3: Default messages will be used.
Current trace stack:
phonon_linear_response
phonon_dynamical_matrix
phonon_calculate_std_kpoints
phonon_calculate
castep
application called MPI_Abort(MPI_COMM_WORLD
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sunyang1988: ½ð±Ò+1, лл½»Á÷ 2013-10-11 15:52:42
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3Â¥: Originally posted by ´óº£12345 at 2013-10-09 10:19:40
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Better Late Than Never
4Â¥2013-10-11 08:27:53
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sunyang1988: ½ð±Ò+1, лл½»Á÷ 2013-10-11 15:52:33
Õâ¸öÎÊÌâͬÑùÒ²À§ÈÅÎÒ£¬»òÐíÊÇÄÚ´æ²»¹» µçÄÔ´ø²»¶¯°É Òª²»¾ÍÊǾ«¶È²»¹»
Better Late Than Never
2Â¥2013-10-08 10:58:41
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ÒýÓûØÌû:
2Â¥: Originally posted by lq6865387 at 2013-10-08 10:58:41
Õâ¸öÎÊÌâͬÑùÒ²À§ÈÅÎÒ£¬»òÐíÊÇÄÚ´æ²»¹» µçÄÔ´ø²»¶¯°É Òª²»¾ÍÊǾ«¶È²»¹»

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3Â¥2013-10-09 10:19:40
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