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Spin potential

In the realistic case where the potential is spin-dependent, the spin-orbit method is in trouble (should the spin-orbit parameter be calculated with the up or the down spin potential ). The present formalism allows for the use of spin-dependent potential and wavefunctions. [Pg.454]

Vargas, R., Galvan, M., Vela, A., 1998, Singlet-Triplet Gaps and Spin Potentials , J. Phys. Chem. A, 102, 3134. [Pg.304]

Spin potential, spin hardness, spin-donicity, and spin-philicity indexes have also been applied successfully to other specific problems [19,23,24]. [Pg.150]

Spin-potential in density functional theory framework... [Pg.4]

For such a process, Galvan et al. [32] wrote the spin potential as... [Pg.5]

As a first order approximation, the SP-DFT approach connects the spin-potential directly with the singlet-triplet excitation energy. Thus, the gap defined by the highest beta occupied molecular orbital, HOMO, and the... [Pg.8]

Table 2 Spin-potential, e iMC) — eHOMO SaP an< singlet-triplet excitation energy, AE, for Ca, Sr and Ba The confinement radius, Rc, is reported in atomic units and the other quantities in eV... Table 2 Spin-potential, e iMC) — eHOMO SaP an< singlet-triplet excitation energy, AE, for Ca, Sr and Ba The confinement radius, Rc, is reported in atomic units and the other quantities in eV...
Figure 5 Excitation energy versus spin-potential for Ca (circles), Sr (squares) and Ba (triangles). Figure 5 Excitation energy versus spin-potential for Ca (circles), Sr (squares) and Ba (triangles).
Finally, with regard to (iii), after the discovery of the spin-1/2 character of the electron and the associated magnetic moment, it was obvious that spin-dependent terms must be added to U]j, corresponding to the interaction of the magnetic field produced by "1" with the magnetic moment of "2" and vice versa. This led to the now familiar spin-other-orbit and spin-spin potentials and gave... [Pg.434]

If one adopts a spin-spin potential analogous to the Breit-Fermi contact term in atomic physics, namely [103]... [Pg.65]

So far, the applications of the spin-spin potential (11.4) were restricted to mass splittings such as A-N. We now look at the effect of the hyperfine interactions on the wave function of the neutron. The spin-spin potential pushes the d quarks apart a little. In more technical terms, some mixed-symmetry components are introduced into the wave function. [Pg.70]

In fact the spin-spin potential (11.4), which we repeatedly used throughout this chapter, is only a part of the chromomagnetic interaction... [Pg.71]


See other pages where Spin potential is mentioned: [Pg.613]    [Pg.615]    [Pg.615]    [Pg.253]    [Pg.143]    [Pg.144]    [Pg.145]    [Pg.146]    [Pg.148]    [Pg.148]    [Pg.149]    [Pg.149]    [Pg.189]    [Pg.335]    [Pg.339]    [Pg.4]    [Pg.8]    [Pg.9]    [Pg.9]    [Pg.10]    [Pg.11]    [Pg.123]    [Pg.82]    [Pg.459]    [Pg.6]    [Pg.59]   


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Chemical reactivity spin potential

Density Functional Theory spin potential

Difference potentials, spin-orbit operators

Effective core potentials coupled-cluster spin-orbit effects

Ionization potentials, spin-orbit coupling

Ionization potentials, spin-orbit coupling effects

Model potentials spin-orbit interaction

Molecular potential spin symmetry

Nucleus spin-orbit potential

Open Shell Atomic Beam Scattering and the Spin Orbit Dependence of Potential Energy Surfaces

Operators Pseudo-potential spin-orbit

Potential matrix element spin-orbit

Quantum potential spin-dependent

Scalar-relativistic/spin-free potential

Scattering potentials, electron spin-0 particle

Spin dependence of the potential

Spin-Orbit Coupling and Relativistic Effective Potentials—Applications

Spin-orbit effects ionization potentials

Spin-orbit operators relativistic effective core potential

Spin-orbit operators relativistic effective core potentials-based

Spin-orbit potential

Spin-potential in density functional theory framework

Vector Potential, Nuclear Spin

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