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[单晶结构] 更新已申请CCDC号且已发表的CIF

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发表于 2025-4-20 09:07:36 | 查看全部 |阅读模式
已经发表的CIF文件也是可以更新的,所以投稿前,可以先把CIFCCDC公开(晶体数据审稿意见-在手稿前公开结构(CCDC)),后面根据审稿意见修改CIF后,再把最新的CIF文件上传CCDC进行更新即可。
要更新CIF文件,其实比申请CCDC就多了一个步骤,就是把需要更新CIF文件的CCDC号输入More Information栏即可,如1所示。
1 More Information栏输入需要更新CIF文件的CCDC
具体操作过程请参阅视频:
更新已申请CCDC号且已发表的CIFhttps://www.bilibili.com/video/BV1sH4y1a7dX
以下是该CIF申请CCDC号、发表在CSD以及发表后更新CIF文件的相关邮件:
申请成功邮件:
DearDepositor,
Thankyou for depositing your crystal structure(s) via the joint CCDC/FIZ Karlsruhedeposition service.
Thedata have been assigned the following deposition numbers which can either bequoted as CCDC Numbers or CSD Numbers. A CCDC Number is usually quoted for anorganic or metal-organic structure, whereas a CSD Number is usually quoted foran inorganic structure.
CCDCXXXXXXX-YYYYYYY (generally used for organic and metal-organic structures)
CSDXXXXXXX-YYYYYYY (generally used for inorganic structures)
DepositionNumber 2332249
---------------------------------------------------------------
Summary of Data - Deposition Number 2332249
---------------------------------------------------------------
Compound Name:
Data Block Name: data_r20181107d
Unit Cell Parameters: a 23.997(3) b 23.997(3) c 10.659(2) R-3
---------------------------------------------------------------
Afterpublication your data will be made available through our joint AccessStructures service. In addition, organic and metal-organic experimentalstructures will be curated into the Cambridge Structural Database and inorganicexperimental structures will be curated into the Inorganic Crystal StructureDatabase.
Ifyou selected “Publish in a Database” your data will be immediately publishedthrough our joint Access Structures service.
Pleasenote, if any of these structures are not published within one year from todayand we cannot contact you to discuss the matter, then we may publish the datadirectly through the CSD as a CSD Communication or the ICSD as an ICSDCommunication.
Ifwe have any queries relating to the data then we may contact you later.
KindRegards,
TheCCDC and FIZ Karlsruhe Deposition Teams
发表成功邮件:
DearDepositor/Crystallographer,
Oneof your structures has been published as a CSD Communication and now has a DOIand full CCDC Citation. It is now publicly available through our AccessStructures and WebCSD services and you can search for your data using thedetails below.
===========================================
DOI: 10.5517/ccdc.csd.cc2j8wvk
CCDC Number: 2332249
===============================================
Yourstructure has already undergone automated curation and will now be queued formanual curation by one of our expert Scientific Editors at the CCDC. If theyhave any questions about your structure during curation they will contact you.You can find out more about how long our curation processes take here.
Thisstructure has been published as a CSD Communication because the option to"Publish in a database" was selected during Deposition or through ourMy Structures service. If this was done in error please emaildeposit@ccdc.cam.ac.uk and they will update your data accordingly.
Manythanks for your continued support and for depositing your data.
KindRegards
TheCCDC
更新成功邮件:
DearDepositor,
Thankyou for depositing your crystal structure(s) via the joint CCDC/FIZ Karlsruhedeposition service.
Thedata have been assigned the following deposition numbers which can either bequoted as CCDC Numbers or CSD Numbers. A CCDC Number is usually quoted for anorganic or metal-organic structure, whereas a CSD Number is usually quoted foran inorganic structure.
CCDCXXXXXXX-YYYYYYY (generally used for organic and metal-organic structures)
CSDXXXXXXX-YYYYYYY (generally used for inorganic structures)
DepositionNumber 2332249
---------------------------------------------------------------
Summary of Data - Deposition Number 2332249
---------------------------------------------------------------
Compound Name:
Data Block Name: data_(dmpn)ni
Unit Cell Parameters: a 23.997(3) b 23.997(3) c 10.659(2) R-3
---------------------------------------------------------------
Afterpublication your data will be made available through our joint AccessStructures service. In addition, organic and metal-organic experimentalstructures will be curated into the Cambridge Structural Database and inorganicexperimental structures will be curated into the Inorganic Crystal StructureDatabase.
Ifyou selected “Publish in a Database” your data will be immediately publishedthrough our joint Access Structures service.
Pleasenote, if any of these structures are not published within one year from todayand we cannot contact you to discuss the matter, then we may publish the datadirectly through the CSD as a CSD Communication or the ICSD as an ICSDCommunication.
Ifwe have any queries relating to the data then we may contact you later.
KindRegards,
TheCCDC and FIZ Karlsruhe Deposition Teams

如需PDF文档,请从以下链接下载:
通过网盘分享的文件:更新已申请CCDC号且已发表的CIF.pdf

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