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Relativistic effects, spin-orbit coupling and non-collinear ... - WIEN 2k

Relativistic effects, spin-orbit coupling and non-collinear ... - WIEN 2k

Relativistic effects, spin-orbit coupling and non-collinear ... - WIEN 2k

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<strong>Relativistic</strong> <strong>effects</strong> in a solidFor a molecule or a solid:<strong>Relativistic</strong> <strong>effects</strong> originate deep inside the core.It is then sufficient to solve the relativistic equations in a sphericalatomic geometry (inside the atomic spheres of <strong>WIEN</strong><strong>2k</strong>).Justify an implementation of the relativistic <strong>effects</strong> only inside themuffin-tin atomic spheres

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