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yangjuan8880

银虫 (正式写手)


[交流] 一晶体数据有3个A错,请给位高手帮忙重修!

自己Checkcif 时没有这些错误,
可Acta 投稿系统中,上传了CIF与FCF文件后出现下面的A错:
Alert level A
PLAT971_ALERT_2_A Large Calcd. Non-Metal Positive Residual Density       4.83 eA-3
PLAT973_ALERT_2_A Large Calcd. Positive Residual Density on    Pr1       2.13 eA-3
PLAT973_ALERT_2_A Large Calcd. Positive Residual Density on    Pr2       2.01 eA-3
不知给位高人能否帮忙修改下,如方便请留下邮箱。
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hjh509

铁杆木虫 (职业作家)


yangjuan8880(金币+5): 2011-06-17 16:09:18
2楼2011-06-16 18:41:00
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yangjuan8880

银虫 (正式写手)


引用回帖:
Originally posted by hjh509 at 2011-06-16 18:41:00:
hjh509@swu.edu.cn

不知道你有没有帮我修改这个结构呀?
3楼2011-06-17 16:09:55
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