密度泛函理论
位阻效应
共轭体系
结晶学
分子
磁矩
金属有机骨架
金属
扫描隧道显微镜
化学
齿合度
八面体
格子(音乐)
材料科学
计算化学
纳米技术
立体化学
凝聚态物理
物理化学
物理
晶体结构
吸附
有机化学
聚合物
声学
作者
Cheng‐Kun Lyu,Yifan Gao,Ziang Gao,Song‐Yu Mo,Muqing Hua,En Li,Shu‐Qing Fu,Jia‐Yan Chen,Pei Nian Liu,Huang Li,Nian Lin
标识
DOI:10.1002/ange.202204528
摘要
Abstract 1,4,5,8,9,12‐Hexaazatriphenylene (HAT) is one of the smallest polyheterocyclic aromatic building blocks for forming conjugated metal–organic frameworks (cMOFs). However, the strong inter‐molecular steric hindrance impedes the growth of HAT‐based cMOFs. Here we employ on‐surface synthesis to grow single‐layer two‐dimensional cMOFs of M 3 (HAT) 2 (M=Ni, Fe, Co). Using scanning tunnelling microscopy and density‐functional theory (DFT) analysis, we resolve that the frameworks comprise a hexagonal lattice of HAT molecules and a Kagome lattice of metal atoms. The DFT analysis indicates that Ni, Co and Fe carry a magnetic moment of 1.1, 2.5, and 3.7 μB, respectively. We anticipate that the small π‐conjugated core of HAT and strong bidentate chelating coordination give rise to appealing electronic and magnetic properties.
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