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由原子的局域排斥、自旋轨道耦合和极化率控制的分子和凝聚态物质的物理性质。

Physical Properties of Molecules and Condensed Materials Governed by Onsite Repulsion, Spin-Orbit Coupling and Polarizability of Their Constituent Atoms.

机构信息

Department of Chemistry, North Carolina State University, Raleigh, NC 27695-8204, USA.

State Key Laboratory of Structural Chemistry, Fujian Institute of Research on the Structure of Matter, Chinese Academy of Sciences, Fuzhou 350002, China.

出版信息

Molecules. 2020 Feb 16;25(4):867. doi: 10.3390/molecules25040867.

DOI:10.3390/molecules25040867
PMID:32079082
原文链接:https://pmc.ncbi.nlm.nih.gov/articles/PMC7070676/
Abstract

The onsite repulsion, spin-orbit coupling and polarizability of elements and their ions play important roles in controlling the physical properties of molecules and condensed materials. In celebration of the 150th birthday of the periodic table this year, we briefly review how these parameters affect the physical properties and are interrelated.

摘要

元素及其离子的现场排斥、自旋轨道耦合和极化率在控制分子和凝聚态材料的物理性质方面起着重要作用。值此元素周期表诞生 150 周年之际，我们简要回顾了这些参数如何影响物理性质以及它们之间的相互关系。

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本文引用的文献

1
Key Factors Controlling the Large Second Harmonic Generation in Nonlinear Optical Materials.控制非线性光学材料中大二阶谐波产生的关键因素。
ACS Appl Mater Interfaces. 2020 Feb 26;12(8):9434-9439. doi: 10.1021/acsami.9b20023. Epub 2020 Feb 12.
2
Dependence of the Second-Harmonic Generation Response on the Cell Volume to Band-Gap Ratio.二次谐波产生响应与细胞体积与带隙比的关系。
Inorg Chem. 2019 Aug 5;58(15):9572-9575. doi: 10.1021/acs.inorgchem.9b01368. Epub 2019 Jul 11.
3
Electronic and Structural Factors Controlling the Spin Orientations of Magnetic Ions.
电子和结构因素对磁性离子的自旋取向的控制。
Inorg Chem. 2019 Sep 16;58(18):11854-11874. doi: 10.1021/acs.inorgchem.9b00687. Epub 2019 Jun 18.
4
A linear cobalt(II) complex with maximal orbital angular momentum from a non-Aufbau ground state.具有最大轨道角动量的线性钴(II)配合物来自非 Aufbau 基态。
Science. 2018 Dec 21;362(6421). doi: 10.1126/science.aat7319. Epub 2018 Nov 15.
5
Magnetic blocking in a linear iron(I) complex.线性铁（I）配合物中的磁阻断。
Nat Chem. 2013 Jul;5(7):577-81. doi: 10.1038/nchem.1630. Epub 2013 May 5.
6
Persistent triplet carbenes.持久性三线态卡宾
Chem Rev. 2009 Aug;109(8):3275-332. doi: 10.1021/cr800518t.
7
Effects of spin-orbit coupling on magnetic properties of discrete and extended magnetic systems.自旋轨道耦合对离散和扩展磁性系统磁性能的影响。
J Comput Chem. 2008 Oct;29(13):2187-209. doi: 10.1002/jcc.21011.
8
Ferromagnetism in the Mott insulator Ba2NaOsO6.莫特绝缘体Ba2NaOsO6中的铁磁性
Phys Rev Lett. 2007 Jul 6;99(1):016404. doi: 10.1103/PhysRevLett.99.016404.
9
Analysis of the uniaxial magnetic properties of high-spin d(6) ions at trigonal prism and linear two-coordinate sites: uniaxial magnetic properties of Ca(3)Co(2)O(6) and Fe[C(SiMe(3))(3)](2).三角棱柱和线性二配位位点上高自旋d(6)离子的单轴磁性质分析：Ca(3)Co(2)O(6)和Fe[C(SiMe(3))(3)](2)的单轴磁性质
Inorg Chem. 2005 Jun 13;44(12):4407-14. doi: 10.1021/ic050185g.
10
Virtual free ion magnetism and the absence of Jahn-Teller distortion in a linear two-coordinate complex of high-spin iron(II).高自旋铁（II）线性二配位配合物中的虚拟自由离子磁性与 Jahn-Teller 畸变的缺失
J Am Chem Soc. 2004 Aug 25;126(33):10206-7. doi: 10.1021/ja030632w.