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tancaiping

铜虫 (小有名气)

[交流] 请高手解答投稿过程中碰到晶体结构相关的问题

最近投一篇文章,审稿人提了两个问题:

1) The ellipsoid plot clearly shows some form of non-systematic error in the data (prolate ellipsoids with a common elongation direction), this is often related to a poorly applied absorption correction. The authors should investigate this.

2) The experimental does not mention the treatment of the solvent water. It is clear from the files that these have been modelled as partially occupied without hydrogens located. This should be described in the experimental.

第一个好像是说吸收校正做得不好,请问这个这么解决啊?

因为本人不是做晶体结构的,还望高手指点迷津哦。

不胜感激!!!!!
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