Magnetism: Molecules to Materials IVJoel S. Miller, Marc Drillon Magnetic phenomena and materials are everywhere. Our understanding of magnetic behavior, once thought to be mature, has enjoyed new impetus from contributions ranging from molecular chemistry, materials chemistry and sciences to solid state physics. New phenomena are explored that open promising perspectives for commercial applications in future - carrying out chemical reactions in magnetic fields is just one of those. The spectrum spans molecule-based - organic, (bio)inorganic, and hybrid - compounds, metallic materials as well as their oxides forming thin films, nanoparticles, wires etc. Reflecting contemporary knowledge, this open series of volumes provides a much-needed comprehensive overview of this growing interdisciplinary field. Topical reviews written by foremost scientists explain the trends and latest advances in a clear and detailed way. By maintaining the balance between theory and experiment, the book provides a guide for both advanced students and specialists to this research area. It will help evaluate their own experimental observations and serve as a basis for the design of new magnetic materials. A unique reference work, indispensable for everyone concerned with the phenomena of magnetism! |
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Page viii
... Calculations 4.3 Applications to Spin Clusters 4.4 Field Theoretic Studies of Spin Chains 4.4.1 4.4.2 Nonlinear o ... Calculation of Properties in the DMRG Basis 4.5.4 Remarks on the Applications of DMRG 4.6 Frustrated and Dimerized Spin ...
... Calculations 4.3 Applications to Spin Clusters 4.4 Field Theoretic Studies of Spin Chains 4.4.1 4.4.2 Nonlinear o ... Calculation of Properties in the DMRG Basis 4.5.4 Remarks on the Applications of DMRG 4.6 Frustrated and Dimerized Spin ...
Page ix
... Calculations : Butler - Banerjee Model . 213 6.2.5 Local Energy Minima and Metastable SD States : Micromagnetic Models ... 214 6.2.6 Magnetic Anisotropy of Magnetosomes 215 6.2.7 Magnetosome Chains . . 6.2.8 Magnetic Properties of ...
... Calculations : Butler - Banerjee Model . 213 6.2.5 Local Energy Minima and Metastable SD States : Micromagnetic Models ... 214 6.2.6 Magnetic Anisotropy of Magnetosomes 215 6.2.7 Magnetosome Chains . . 6.2.8 Magnetic Properties of ...
Page x
... Calculation of Spin - Hamiltonian Parameters in Transition Metal Complexes 9.2 The Spin - Hamiltonian 9.2.1 The SH . . . . Eigenstates of the SH 9.2.3 Matrix Elements of the SH Comments . . . . 9.3 The Physical Origin of Spin ...
... Calculation of Spin - Hamiltonian Parameters in Transition Metal Complexes 9.2 The Spin - Hamiltonian 9.2.1 The SH . . . . Eigenstates of the SH 9.2.3 Matrix Elements of the SH Comments . . . . 9.3 The Physical Origin of Spin ...
Page xi
... Calculation of g - Values 9.6.8 Calculation of Hyperfine Couplings 9.7 Concluding Remarks . . . 9.8 Appendix : Calculation of Spin - Orbit Coupling Matrix Elements . . 456 References 10 Chemical Reactions in Applied Magnetic Fields 458 ...
... Calculation of g - Values 9.6.8 Calculation of Hyperfine Couplings 9.7 Concluding Remarks . . . 9.8 Appendix : Calculation of Spin - Orbit Coupling Matrix Elements . . 456 References 10 Chemical Reactions in Applied Magnetic Fields 458 ...
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Contents
Biogenic Magnets | 6 |
References | 94 |
Exact and Approximate Theoretical Techniques | 119 |
73 | 171 |
Theoretical Study of the Electronic Structure of | 173 |
102 | 192 |
Magnetic Ordering due to Dipolar Interaction | 233 |
3D of 1D Bunching of Wires or Chains | 248 |
Spin Transition Phenomena | 271 |
Magnetic Properties of Selfassembled 2 2 and 3 3 Grids | 345 |
Interpretation and Calculation of SpinHamiltonian Parameters | 356 |
References | 441 |
345 | 456 |
355 | 465 |
Chemical Reactions in Applied Magnetic Fields | 467 |
483 | |
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Common terms and phrases
anisotropy antiferromagnetic approximation atomic spin population axial B3LYP basis set behavior bond C(sp² calculations cell centers Chem complexes computed configuration contribution coordination coupling covalency crystal curve decreases density matrix dependence dimensional dimer dipolar interaction dipole distances DMRG dominant effect eigenstates electronic structure equation exchange interaction excited experimental fermion ferromagnetic g-tensor g-values grid ground Gütlich Hamiltonian Hartree-Fock hysteresis increase Inorg iron(II isotropic Kahn lattice Lett LIESST ligand field ligand field theory low temperature magnetic field magnetic interactions magnetic ordering magnetic properties magnetite magnetosomes magnetotactic bacteria matrix elements metal ions method molecular molecules Mössbauer nitronyl nitroxide nitroxide observed obtained ONCNO groups operator orbitals phase Phys prediction quantum radicals Section SH parameters shown in Fig single singlet singly occupied spectroscopy spin chains spin density spin transition symmetry term thermal tion total spin transition metal values wavefunction zero