Hybrid density functional theory studies on the magnetic interactions and the weak covalent bonding for the phenalenyl radical dimeric pair.
about
Interactions and Self-Assembly of Stable Hydrocarbon Radicals on a Metal Support.First principles effective electronic couplings for hole transfer in natural and size-expanded DNA.Calculation of microscopic exchange interactions and modelling of macroscopic magnetic properties in molecule-based magnets.Synthesis and characterisation of p-block complexes of biquinoline at different ligand charge states.Control of Exchange Interactions in π Dimers of 6-Oxophenalenoxyl Neutral π Radicals: Spin-Density Distributions and Multicentered-Two-Electron Bonding Governed by Topological Symmetry and Substitution at the 8-Position.The inter-ring sigma/(pi/pi) covalent interactions of cyclodimes of benzenes.Temperature-dependent ESR and computational studies on antiferromagnetic electron transfer in the yeast NADH dehydrogenase Ndi1.Origin of Bistability in the Butyl-Substituted Spirobiphenalenyl-Based Neutral Radical Material.Cethrene: A Helically Chiral Biradicaloid Isomer of Heptazethrene.Singlet fission in pancake-bonded systems.Spreading out spin density in polyphenalenyl radicals.Two-electron/24-center (2e/24c) bonding in novel diradical π-dimers.Concave or convex π-dimers: the role of the pancake bond in substituted phenalenyl radical dimers.Phenalenyl-Based Open-Shell Polycyclic Aromatic HydrocarbonsDimethylcethrene: A Chiroptical Diradicaloid Photoswitch
P2860
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P2860
Hybrid density functional theory studies on the magnetic interactions and the weak covalent bonding for the phenalenyl radical dimeric pair.
description
2002 nî lūn-bûn
@nan
2002年の論文
@ja
2002年学术文章
@wuu
2002年学术文章
@zh
2002年学术文章
@zh-cn
2002年学术文章
@zh-hans
2002年学术文章
@zh-my
2002年学术文章
@zh-sg
2002年學術文章
@yue
2002年學術文章
@zh-hant
name
Hybrid density functional theo ...... enalenyl radical dimeric pair.
@en
Hybrid density functional theo ...... enalenyl radical dimeric pair.
@nl
type
label
Hybrid density functional theo ...... enalenyl radical dimeric pair.
@en
Hybrid density functional theo ...... enalenyl radical dimeric pair.
@nl
prefLabel
Hybrid density functional theo ...... enalenyl radical dimeric pair.
@en
Hybrid density functional theo ...... enalenyl radical dimeric pair.
@nl
P2093
P356
P1476
Hybrid density functional theo ...... enalenyl radical dimeric pair.
@en
P2093
Hiroshi Isobe
Kagetoshi Yamamoto
Kazuhiro Nakasuji
Kizashi Yamaguchi
Takeji Takui
Takeshi Taniguchi
Yasushi Morita
P304
11122-11130
P356
10.1021/JA0177197
P407
P50
P577
2002-09-01T00:00:00Z