Broken-Symmetry and Approximate Spin-Projected Potential Energy Curves for Bimetallic Systems: A Density Functional Study of M2Cl9, M = CrIII, MoIII, WIII, and ReIV-Reference-Cited by-同舟云学术

Broken-Symmetry and Approximate Spin-Projected Potential Energy Curves for Bimetallic Systems: A Density Functional Study of M2Cl9, M = CrIII, MoIII, WIII, and ReIV

Published:1997-08-01 Issue:35 Volume:101 Page:6265-6272
ISSN:1089-5639
Container-title:The Journal of Physical Chemistry A
language:en
Short-container-title:J. Phys. Chem. A

Author:

McGrady John E.¹,Stranger Robert¹,Lovell Timothy¹

Affiliation:

1. Department of Chemistry, The Faculties, The Australian National University, Canberra, ACT 0200, Australia

Publisher

American Chemical Society (ACS)

Subject

Physical and Theoretical Chemistry

Link

https://pubs.acs.org/doi/pdf/10.1021/jp9625568

Reference48 articles.

1. Magnetic exchange in transition metal complexes. 12. Calculation of cluster exchange coupling constants with the X.alpha.-scattered wave method

2. Ground-state electronic structures and other electronic properties of the octahedral and oligooctahedral ruthenium complexes hexachlororuthenium(III), nonachlorodiruthenium(III) and dodecachlorotriruthenium(II, 2III)

3. Molecular and Electronic Structure of the Confacial Diosmium(III) Nonabromide Complex Anion. X-ray Crystallography of Rb3Os2Br9 and Direct Comparisons of [Os2Br9]3- with [Ru2Br9]3-

Cited by 68 articles. 订阅此论文施引文献订阅此论文施引文献，注册后可以免费订阅5篇论文的施引文献，订阅后可以查看论文全部施引文献

1. A Computational Exploration of Exohedrally Transition Metal Doped Si₉^4– Superatom Based Magnetic MSi₉M′ Clusters (M, M′ = Sc(II) to Cu(II));The Journal of Physical Chemistry A;2023-11-17

2. Computational study of the [(CO)2(benzoate)MII/III(terephthalate)]0/1+ complexes with M = V, Cr, Mn, Fe and Co;Computational and Theoretical Chemistry;2019-05

3. RETRACTED: DFT challenge of intermetallic interactions: From metallophilicity and metallaromaticity to sextuple bonding;Coordination Chemistry Reviews;2017-08

4. A multiconfigurational approach to the electronic structure of trichromium extended metal atom chains;Dalton Transactions;2017

5. Metal–Metal Bonding in Trinuclear, Mixed-Valence [Ti3X12]4– (X = F, Cl, Br, I) Face-Shared Complexes;Inorganic Chemistry;2015-11-02