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kele1988

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Writing model to 280396_Ta2O5_fine.check
Error in geom_get_forces - electronic_minimisation of current_cell failed
Current trace stack:
geom_get_forces
geom_BFGS
geometry_optimise
castep
Error in geom_get_forces - electronic_minimisation of current_cell failed
Current trace stack:
geom_get_forces
geom_BFGS
geometry_optimise
castep
Error in geom_get_forces - electronic_minimisation of current_cell failed
Current trace stack:
geom_get_forces
geom_BFGS
geometry_optimise
castep
Error in geom_get_forces - electronic_minimisation of current_cell failed
Current trace stack:
geom_get_forces
geom_BFGS
geometry_optimise
castep
Error in geom_get_forces - electronic_minimisation of current_cell failed
Current trace stack:
geom_get_forces
geom_BFGS
geometry_optimise
castep
Error in geom_get_forces - electronic_minimisation of current_cell failed
Current trace stack:
geom_get_forces
geom_BFGS
geometry_optimise
castep
Error in geom_get_forces - electronic_minimisation of current_cell failed
Current trace stack:
geom_get_forces
geom_BFGS
geometry_optimise
castep
Error in geom_get_forces - electronic_minimisation of current_cell failed
Current trace stack:
geom_get_forces
geom_BFGS
geometry_optimise
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.
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.
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.
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: Defa
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css8170

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Error in geom_get_forces - electronic_minimisation of current_cell failed
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2Â¥2012-11-10 10:16:05
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kele1988

Í­³æ (³õÈëÎÄ̳)

ÒýÓûØÌû:
2Â¥: Originally posted by css8170 at 2012-11-10 10:16:05
Error in geom_get_forces - electronic_minimisation of current_cell failed
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3Â¥2012-11-10 13:42:58
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