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donggaomin

½ð³æ (ÕýʽдÊÖ)

ÒýÓûØÌû:
Originally posted by byin at 2011-05-22 19:29:51:
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22Â¥2011-05-22 20:15:17
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byin

Í­³æ (ÕýʽдÊÖ)

ÒýÓûØÌû:
Originally posted by donggaomin at 2011-05-22 20:15:17:
½â¾öÁË£¬¼ÓÁËSPIN = 2 Ìå»ý¾ÍÉÏÈ¥ÁË£¬ÔÙµ÷һϴžظüºÃ

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23Â¥2011-05-23 14:22:56
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byin

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24Â¥2011-05-26 13:59:22
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byin

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25Â¥2011-05-26 14:00:00
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donggaomin

½ð³æ (ÕýʽдÊÖ)

ÒýÓûØÌû:
Originally posted by byin at 2011-05-26 13:59:22:
SYSTEM=BiFeO3_R3C
#------------------------
PREC=ACCURATE
ISTART=0
ICHARG=2
ISPIN=2
MAGMOM=0 0 0 0 0 0 6 -6 0 0
#------------------------
ENCUT=875
NELMIN=4
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26Â¥2011-05-26 16:30:49
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donggaomin

½ð³æ (ÕýʽдÊÖ)

ÒýÓûØÌû:
Originally posted by byin at 2011-05-26 14:00:00:
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27Â¥2011-05-26 17:16:56
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