求助各位虫友，怎么建立利用MOF-74的cif文件去建立它的分子文件呢？对于这种非立方晶体，怎么来算其中...
求助 锰(Mn)-MOF-74晶体CIF文件和CCDC号，谢谢！！
① 输入MOF的名称(Compound name),CCDC号等点击搜索即可,如此处ZIF-8、MOF-5 或sulfadiazine等,点击搜索。 ② 找到所需要的结构,选中要下载的结构(√),点击Download Selected,选择CIF下载(姓名,邮箱,单位随意写),并将其保存到一个没有中文路径的文件夹(mercury有些版本需要英文路径的cif文件,才能打开) ① 打开me...
Additionally, the MOFSimplify interface encourages community engagement by enabling the user to add new MOF data to our database by uploading MOF CIF files and TGA traces in the Data Upload tab. MOFSimplify also lets the user indicate whether they agree with an ANN prediction or curated experime...
Data S1. CIF of dptz-CuTiF6. The crystal structure data and structure determination for dptz-CuTiF6. Download: Download zip file (231KB) Data S2. CIF of dptz-CuSiF6. The crystal structure data and structure determination for CIF of dptz-CuSiF6. Download: Download zip file (29KB) ...
MOF5-CIF data_MOF-5 _database_code_depnum_ccdc_archive 'CCDC 277428'_audit_creation_method SHELXL-97 _chemical_name_common 'MOF-5, evacuated'_chemical_formula_moiety 'C24 H12 O13 Zn4'_chemical_formula_structural 'Zn4 O (C8 H4 O4)3'_chemical_formula_sum 'C24 H12 O13...
(II)金属分别与一个水分子配位 并在四个配体中八个羧基氧原子 共同的配位作用下形成 二维层状结构,Mn‑MOF单晶材料由二维层状结构堆积形成,层间距为 单层厚度为 [0049] XRD结果见图2,该图显示测得Mn‑MOF材料的X射线粉末衍射曲线与X射线单晶衍射 的CIF文件的模拟曲线(Mn‑MOF‑simulated)基本吻合,表明...
[1e4ta5l],spcoacrirnogd,ihnigghthsepePcCifiNc saunrfdacfeoarmreain, g poarneds.hTighhismseimtalpaletosmynlothaedsiinsgs, twepaseoxbptaanindesdibtsyscpaercbiofnicizsautriofanc.eTahreeyafoanudndptrhoavtitdheesfltorawnesrf-er ncµhamlZaianskInocFoeoln-fZ8lrehYobIlb−awsFi1ecn),-c.e...
((aa)) SScchheemmaattiicc ddiiaaggrraamm ooff tthhee oonnee--sstteepp ssyynntthheessiiss ooff ccoorree--sshheellll mmeettaall––oorrggaanniicc ffrraammeewwoorrkk (hs(hbbiyyo))bbnSSrrcificddrhhosseem::mmPPaRaCCtteiNNicfc.--i2i[2ll5l2l2u0u22s]s@@,ttr2ZrZaa0rtrt2-i-ioB3oBn,PnP...
"integrity": "sha1-G2gcIf+EAzyCZUMJBolCDRhxUdw=" }, "clone": { "version": "2.1.2", "resolved": "https://registry.npmjs.org/clone/-/clone-2.1.2.tgz", "integrity": "sha1-G39Ln1kfHo+DZwQBYANFoCiHQ18=" },