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4010808

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Reading from POSCAR number of atoms in species...
Since fort.14/CONTCAR file is not available,
specify number of atoms in every species from 1 till  1
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yongleli

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zzy870720z(½ð±Ò+1):ллÌáʾ 2010-12-06 15:56:12
4010808(½ð±Ò+1): 2010-12-07 09:58:34
ÒýÓûØÌû:
Originally posted by 4010808 at 2010-12-06 14:24:09:
ÎÒÔÚÓÃlev00´¦ÀíµçºÉÃܶÈʱ£¬°´ÕÕºîÀÏʦ½²ÒåÉϵIJ½Ö裬µ±ÊäÈëÁËPOSCAR&CONTCARºó³öÏÖÕâÑùµÄÌáʾ£º
Reading from POSCAR number of atoms in species...
Since fort.14/CONTCAR file is not available,
spe ...

ÊDz»ÊÇÄãÓõÄVASP5.2?
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4010808

ľ³æ (СÓÐÃûÆø)


ÒýÓûØÌû:
Originally posted by yongleli at 2010-12-06 15:24:22:


ÊDz»ÊÇÄãÓõÄVASP5.2?
CONTCARÀïÓÐûÓÐÔ­×ÓÃû³Æ£¿ÈôÓУ¬É¾È¥ÕâÒ»Ðм´¿É£»±ðµÄÔ­ÒòÎÒ²»ÖªµÀ¡£¡£¡£

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3Â¥2010-12-07 09:58:29
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gfei2008

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sunyang1988(½ð±Ò+1):ллָµã 2010-12-10 18:23:20
4010808(½ð±Ò+1): 2010-12-10 19:56:48
Äã°ÑÄãµÄCONTCARÖеÄÔ­×ÓÒÀ´ÎÊäÈë½øÈ¥£¬Ã¿ÊäÈëÒ»Ö־Ͱ´Ò»´Î»Ø³µ
4Â¥2010-12-10 17:29:48
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4010808

ľ³æ (СÓÐÃûÆø)


ÒýÓûØÌû:
Originally posted by gfei2008 at 2010-12-10 17:29:48:
Äã°ÑÄãµÄCONTCARÖеÄÔ­×ÓÒÀ´ÎÊäÈë½øÈ¥£¬Ã¿ÊäÈëÒ»Ö־Ͱ´Ò»´Î»Ø³µ

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5Â¥2010-12-10 19:57:08
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