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[单晶结构] 申请CCDC号并直接发表CIF

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发表于 2025-5-2 09:23:25 | 查看全部 |阅读模式
申请CCDC号时,在步骤5Add Publication)点击“Publish in aDatabase”,如1所示。
1 Publish in a Database
Journalname一栏中系统填入“Databa**munication”,并且其他栏均变为灰色,如2所示,如果此时改变主意不想发表在数据库中,则点击下方的“Clickto remove Database Communication”。
2 Publish in a Database信息
此时点击“Proceedto Next Step”时,弹出ConfirmDatabase Publication对话框,如果确定要将CIF发表在数据库,则点击Confirm;如果改变主意,则点击Go Back,如3所示。
3 发表确认
然后完成剩下的步骤即可。
等待数分钟后,收到邮件(见下方邮件内容),此时在MyStructures列表中可以看到,该CIFStatusPublished,只不过还未分配Refcode,如4所示。
4 数据状态
邮件内容:
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 2332662-2332664
---------------------------------------------------------------
Summaryof Data - Deposition Number 2332662
---------------------------------------------------------------
CompoundName:
DataBlock Name: data_(dppv)fe(co)2i2_acetone
UnitCell Parameters: a 8.8788(18) b 17.841(4) c 29.750(6) P-1
---------------------------------------------------------------
---------------------------------------------------------------
Summaryof Data - Deposition Number 2332663
---------------------------------------------------------------
CompoundName:
DataBlock Name: data_(dppv)fe(co)2i2
UnitCell Parameters: a 16.345(3) b 16.048(3) c 21.152(4) Pbca
---------------------------------------------------------------
---------------------------------------------------------------
Summaryof Data - Deposition Number 2332664
---------------------------------------------------------------
CompoundName:
DataBlock Name: data_(dppv)fe(co)2i2_dcm
UnitCell Parameters: a 8.7691(4) b 18.5959(9) c 18.8989(9) P212121
---------------------------------------------------------------
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
而再过一段时间,申请CCDC号的CIF将具有可引用的DOI号,并收到邮件如下(每个数据一封邮件):
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.cc2j9b5c
CCDCNumber: 2332662
===============================================
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
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.cc2j9b6d
CCDCNumber: 2332663
===============================================
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
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.cc2j9b7f
CCDCNumber: 2332664
===============================================
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
此时数据也被分配了Refcode,如5所示。
5 分配的Refcode
视频操作演示请参阅:
申请CCDC号并直接发表CIFhttps://www.bilibili.com/video/BV1U4421F7DD
如需PDF文档,请从以下链接下载:
通过网盘分享的文件:申请CCDC号并直接发表CIF.pdf

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