Covalent Bonding and the Neutron Magnetic Form Factor of theIon
- 9 March 1970
- journal article
- research article
- Published by American Physical Society (APS) in Physical Review Letters
- Vol. 24 (10), 516-520
- https://doi.org/10.1103/physrevlett.24.516
Abstract
Fully variational unrestricted Hartree-Fock calculations for the cluster are reported. Charge and spin densities are analyzed and shown to result in a neutron magnetic form factor which is contracted relative to the free-ion value in agreement with experiment but contrary to predictions of simple covalent-bonding theory.
Keywords
This publication has 14 references indexed in Scilit:
- Theory of Transition-Metal Complexes: Unrestricted Hartree-Fock Molecular-Orbital Method and Its Application to KNiPhysical Review B, 1968
- Model Calculations for the Study of Direct and Superexchange InteractionsJournal of Applied Physics, 1968
- Covalency Parameters in MnO, α-MnS, and NiOThe Journal of Chemical Physics, 1968
- Covalency effects in neutron diffraction from ferromagnetic and antiferromagnetic saltsProceedings of the Physical Society, 1965
- Measurement of the Covalent Spin Distribution in Manganous Fluoride Using Polarized NeutronsJournal of Applied Physics, 1963
- Orbital Contribution to the Magnetic Form Factor ofPhysical Review B, 1961
- AsphericalElectron Distribution inPhysical Review Letters, 1961
- Unrestricted Hartree-Fock Method: Electron Densities and Magnetic Form Factors for Spin PolarizedPhysical Review B, 1960
- Interactions ofandOrbitals in Transition Element FluoridesPhysical Review Letters, 1960
- Antiferromagnetic Structures of Mn, Mn, and MnPhysical Review B, 1959