晶体结构中有个高
氯酸根无序了,结构见附件,我对精修过程做了描述,如下:
Specially, the uncoordinated ClO4- in 1 was modelled to be rotationally disordered about Cl1–O3 bond, and then it was divided into two parts, in which O1, O2 and O4 was limited to be 1/2 occupancy for refinement.
审稿意见回来后,审稿人的意思好像是说描述的不对?意见如下,不知道应该如何描述才对?
(c) The disorder of ClO4- is about a special position (2-fold axis);