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zcy800204

金虫 (正式写手)

[求助] CIF 中C级错误

PLAT029_ALERT_3_C _diffrn_measured_fraction_theta_full Low .......      0.966      
PLAT340_ALERT_3_C Low Bond Precision on  C-C Bonds ...............     0.0045 Ang  
PLAT910_ALERT_3_C Missing # of FCF Reflections Below Th(Min) .....          1      
PLAT911_ALERT_3_C Missing # FCF Refl Between THmin & STh/L=  0.595         90
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0507030032

金虫 (小有名气)

【答案】应助回帖

★
zcy800204(金币+5): 谢谢 2011-07-21 15:06:02
drg1984(金币+1): 感谢回帖交流! 2011-07-21 17:28:28
zcy800204(金币+5): 2011-07-24 10:17:54
PLAT029_ALERT_3_C _diffrn_measured_fraction_theta_full Low .......      0.966      
在ins中写入 omit -3 52 如果还不行的话,52还可以改小,最小不能低于50,精
修
PLAT910_ALERT_3_C Missing # of FCF Reflections Below Th(Min) .....          1      
PLAT911_ALERT_3_C Missing # FCF Refl Between THmin & STh/L=  0.595         90

之后,这两个值也会发生相应改变
PLAT340_ALERT_3_C Low Bond Precision on  C-C Bonds ...............     0.0045 Ang  
这个是数据本身原因,有的人用damp命令,可以使这个值减小,不过C类警告,问题不是很大。
2楼2011-07-21 14:44:53
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