Detailed ab initio first-principles study of the magnetic anisotropy in a family of trigonal pyramidal iron(II) pyrrolide complexes.
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Trigonal antiprismatic Co(ii) single molecule magnets with large uniaxial anisotropies: importance of Raman and tunneling mechanisms.The role of anharmonic phonons in under-barrier spin relaxation of single molecule magnets.Theoretical determination of spin Hamiltonians with isotropic and anisotropic magnetic interactions in transition metal and lanthanide complexes.High-frequency and high-field electron paramagnetic resonance (HFEPR): a new spectroscopic tool for bioinorganic chemistry.Spectroscopic and Computational Investigation of Low-Spin Mn(III) Bis(scorpionate) Complexes.An Experimental and Theoretical Investigation on Pentacoordinated Cobalt(III) Complexes with an Intermediate S=1 Spin State: How Halide Ligands Affect their Magnetic Anisotropy.Intra-molecular origin of the spin-phonon coupling in slow-relaxing molecular magnets.Single-molecule magnets: Iron lines up.Magnetic blocking in a linear iron(I) complex.Zero-field splitting in nickel(II) complexes: a comparison of DFT and multi-configurational wavefunction calculations.General treatment of the multimode Jahn-Teller effect: study of fullerene cations.Polarized Neutron Diffraction to Probe Local Magnetic Anisotropy of a Low-Spin Fe(III) Complex.Pentagonal Bipyramid FeII Complexes: Robust Ising-Spin Units towards Heteropolynuclear Nanomagnets.EPR/ENDOR and Theoretical Study of the Jahn-Teller-Active [HIPTN3N]MoVL Complexes (L = N-, NH).Syntheses, crystal structures and magnetic properties of two mixed-valence Co(iii)Co(ii) compounds derived from Schiff base ligands: field-supported single-ion-magnet behavior with easy-plane anisotropy.A mononuclear Co(ii) complex formed from pyridinedimethanol with manifold slow relaxation channels.Field effects to slow magnetic relaxation in a mononuclear Ni(ii) complex.A computational examination on the structure, spin-state energetics and spectroscopic parameters of high-valent Fe(IV)=NTs species.NMR analysis of an Fe(i)-carbene complex with strong magnetic anisotropy.A flexible iron(ii) complex in which zero-field splitting is resistant to structural variation.Possibility to realize spin-orbit-induced correlated physics in iridium fluoridesA combined high-field EPR and quantum chemical study on a weakly ferromagnetically coupled dinuclear Mn(iii) complex. A complete analysis of the EPR spectrum beyond the strong coupling limit
P2860
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P2860
Detailed ab initio first-principles study of the magnetic anisotropy in a family of trigonal pyramidal iron(II) pyrrolide complexes.
description
2011 nî lūn-bûn
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2011年の論文
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2011年学术文章
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2011年学术文章
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2011年学术文章
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2011年学术文章
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name
Detailed ab initio first-princ ...... ily of trigonal pyramidal iron
@nl
Detailed ab initio first-princ ...... iron(II) pyrrolide complexes.
@en
type
label
Detailed ab initio first-princ ...... ily of trigonal pyramidal iron
@nl
Detailed ab initio first-princ ...... iron(II) pyrrolide complexes.
@en
prefLabel
Detailed ab initio first-princ ...... ily of trigonal pyramidal iron
@nl
Detailed ab initio first-princ ...... iron(II) pyrrolide complexes.
@en
P50
P356
P1433
P1476
Detailed ab initio first-princ ...... iron(II) pyrrolide complexes.
@en
P2093
Dmitry Ganyushin
Mihail Atanasov
P304
P356
10.1021/IC200196K
P407
P577
2011-07-11T00:00:00Z