应《网络安全法》要求，自2017年10月1日起，未进行实名认证将不得使用互联网跟帖服务。为保障您的帐号能够正常使用，请尽快对帐号进行手机号验证，感谢您的理解与支持！

24小时热门版块排行榜    

Znn3bq.jpeg
小木虫论坛-学术科研互动平台 » 材料区 » 晶体 » 晶体解析 » 晶体审稿人的意见，求高手帮忙
21/1返回列表
查看: 413  |  回复: 1
只看楼主 @他人 存档 新回复提醒 (忽略) 收藏    在APP中查看

vivid217

银虫 (小有名气)

[求助] 晶体审稿人的意见，求高手帮忙

Several solvent water molecules, especially O10, O11 and O12 have very large thermal ellipsoids. The authors may wish to consider a multi-site disorder model, or to make some comment on possible positional disorder of these atoms. It also seems slightly unusual that the hydrogen atom positions for these water molecules have been determined from diffraction measurements rather than calculated given the large ellipsoids of the oxygen. Further investigation of the solvent water positions may also help to address the CheckCIF concerns over large reported positive and negative residual density.It is, however, appreciated that it can be challenging to adequately model disordered solvent and the best course of action may be just to add a comment on potential disorder and relatively large residual density in this case.
看不太懂，审稿人是不是在鬼峰中找氢？是不是还要把O分成两个？
O是溶剂H2O中的啊，很难在鬼峰中找准啊？！
求高手指点
回复此楼

» 猜你喜欢

» 本主题相关价值贴推荐，对您同样有帮助:
1楼 2012-05-15 17:07:02
已阅   回复此楼   关注TA 给TA发消息 送TA红花 TA的回帖

yytsnake

至尊木虫 (职业作家)

【答案】应助回帖

★
感谢参与，应助指数 +1
linhua0402313: 金币+1, 感谢回帖交流！ 2012-05-15 19:29:42
审稿人是说LZ的溶剂水最好作无序处理，这样可以降低残留峰的大小。
赞一下 回复此楼
2楼2012-05-15 17:45:35
已阅   回复此楼   关注TA 给TA发消息 送TA红花 TA的回帖
相关版块跳转 我要订阅楼主 vivid217 的主题更新
21/1返回列表
普通表情 龙 兔 虎 猫
信息提示
关闭
请填处理意见
关闭