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xianggui7895

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bnliu(½ð±Ò+2):лл 2010-11-25 17:19:17
zzy870720z(½ð±Ò+2):ллָ½Ì 2010-11-25 23:07:15
1.¼ÆËãµÄÆðʼµãÓ¦¸ÃÊÇÊÕÁ²ÐÔ²âÊÔ£¬´Ë½×¶ÎÎÞÐë¸Ä±äPOSCAR£¬²»ÓÃISIFºÍIBRION²ÎÊý
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6Â¥2010-11-25 17:12:35
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ustbwgs

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bnliu(½ð±Ò+1):xiexie 2010-11-25 16:54:02
zzy870720z(½ð±Ò+1):лл½»Á÷ 2010-11-25 23:06:45
¾²Ì¬ISIFû±ØÒª±£Áô
3Â¥2010-11-25 13:37:25
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ustbwgs

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bnliu(½ð±Ò+2):Thank you very much. 2010-11-25 16:53:47
zzy870720z(½ð±Ò+1):лл½»Á÷ 2010-11-25 23:06:57
WHEN TESTING PARAMETER, MAITAIN THE POSCAR.BUT FOR OTHERS,POSCAR DOCUMENTS HAVEN'T ANY REAL MEANING.WE COPY THE CONTCAR DOCUMENT INTO POSCAR,AS CONTCAR IS THE RESULT OF RELAXION,SO CONTCAR IS MORE RESONABLE THAN THE INITIAL POSCAR.
4Â¥2010-11-25 14:25:58
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bnliu

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Originally posted by ustbwgs at 2010-11-25 13:37:25:
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