(Q45778757)

16 December 2017

title

The theoretical account of the ligand field bonding regime and magnetic anisotropy in the DySc2N@C80 Single Ion Magnet endohedral fullerene (English)

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16 December 2017

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Harry Ramanantoanina

3

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Fanica Cimpoesu

object named as

Fanica Cimpoesu

1

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Nita Dragoe

object named as

Nita Dragoe

2

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Claude Daul

5

object named as

Claude Daul

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16 December 2017

author name string

Werner Urland

4

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16 December 2017

language of work or name

English

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publication date

30 April 2014

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16 December 2017

Physical Chemistry Chemical Physics

published in

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16 December 2017

volume

16

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16 December 2017

issue

23

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16 December 2017

page(s)

11337-11348

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16 December 2017

Gd2@C79N: Isolation, Characterization, and Monoadduct Formation of a Very Stable Heterofullerene with a Magnetic Spin State of S = 15/2

cites work

1 reference

https://api.crossref.org/works/10.1039%2FC4CP00953C

Internal and external factors in the structural organization in cocrystals of the mixed-metal endohedrals (GdSc2N@Ih-C80, Gd2ScN@Ih-C80, and TbSc2N@Ih-C80) and nickel(II) octaethylporphyrin

21 January 2018

1 reference

https://api.crossref.org/works/10.1039%2FC4CP00953C

Determination of ligand-field parameters and f-electronic structures of double-decker bis(phthalocyaninato)lanthanide complexes

21 January 2018

1 reference

https://api.crossref.org/works/10.1039%2FC4CP00953C

Quantum tunneling of magnetization in lanthanide single-molecule magnets: bis(phthalocyaninato)terbium and bis(phthalocyaninato)dysprosium anions

21 January 2018

1 reference

https://api.crossref.org/works/10.1039%2FC4CP00953C

Nuclear spin driven quantum tunneling of magnetization in a new lanthanide single-molecule magnet: bis(phthalocyaninato)holmium anion

21 January 2018

1 reference

https://api.crossref.org/works/10.1039%2FC4CP00953C

Quantum tunneling of magnetization and related phenomena in molecular materials

21 January 2018

1 reference

https://api.crossref.org/works/10.1039%2FC4CP00953C

Single-molecule magnets: a Mn25 complex with a record S = 51/2 spin for a molecular species

21 January 2018

1 reference

https://api.crossref.org/works/10.1039%2FC4CP00953C

Heterodinuclear Cu-Tb single-molecule magnet

21 January 2018

1 reference

https://api.crossref.org/works/10.1039%2FC4CP00953C

Quantum computing in molecular magnets

21 January 2018

1 reference

https://api.crossref.org/works/10.1039%2FC4CP00953C

Molecular spintronics using single-molecule magnets

21 January 2018

1 reference

https://api.crossref.org/works/10.1039%2FC4CP00953C

Mechanism of ferromagnetic coupling in copper(II)-gadolinium(III) complexes.

21 January 2018

1 reference

https://api.crossref.org/works/10.1039%2FC4CP00953C

Ligand field density functional theory calculation of the 4f2→ 4f15d1 transitions in the quantum cutter Cs2KYF6:Pr3+.

21 January 2018

1 reference

https://api.crossref.org/works/10.1039%2FC4CP00953C

Kohn-Sham theory for ground-state ensembles

21 January 2018

1 reference

https://api.crossref.org/works/10.1039%2FC4CP00953C

General atomic and molecular electronic structure system

21 January 2018

1 reference

https://api.crossref.org/works/10.1039%2FC4CP00953C

Introduction of n-electron valence states for multireference perturbation theory

21 January 2018

1 reference

https://api.crossref.org/works/10.1039%2FC4CP00953C

Chiral crystallization of a heterodinuclear Ni-Ln series: comprehensive analysis of the magnetic properties

21 January 2018

1 reference

https://api.crossref.org/works/10.1039%2FC4CP00953C

Density-functional exchange-energy approximation with correct asymptotic behavior

21 January 2018

1 reference

https://api.crossref.org/works/10.1039%2FC4CP00953C

Density-functional approximation for the correlation energy of the inhomogeneous electron gas

21 January 2018

1 reference

https://api.crossref.org/works/10.1039%2FC4CP00953C

n-electron valence state perturbation theory: A spinless formulation and an efficient implementation of the strongly contracted and of the partially contracted variants

21 January 2018

1 reference

https://api.crossref.org/works/10.1039%2FC4CP00953C

Density-functional theory for ensembles of fractionally occupied states. I. Basic formalism

21 January 2018

1 reference

https://api.crossref.org/works/10.1039%2FC4CP00953C

Does an Encapsulated Atom ‘feel' the Effects of Adsorption?: X-ray Standing Wave Spectroscopy of Ce@C82on Ag(111)

21 January 2018

1 reference

https://api.crossref.org/works/10.1039%2FC4CP00953C

All-Electron Scalar Relativistic Basis Sets for the Lanthanides

21 January 2018

1 reference

https://api.crossref.org/works/10.1039%2FC4CP00953C

An Explicit Quantum Chemical Method for Modeling Large Solvation Shells Applied to Aminocoumarin C151

21 January 2018

1 reference

https://api.crossref.org/works/10.1039%2FC4CP00953C

Electron paramagnetic resonance studies of lanthanum-containing C82

21 January 2018

1 reference

https://api.crossref.org/works/10.1039%2FC4CP00953C

Magnetic bistability in a metal-ion cluster

21 January 2018

1 reference

https://api.crossref.org/works/10.1039%2FC4CP00953C

21 January 2018

Identifiers

DOI

10.1039/C4CP00953C

1 reference

16 December 2017

1 reference

16 December 2017