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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(2) Spin-Orbit splitting of p states Spin-<strong>orbit</strong> splitting of l-quantum numberr 2 (e/bohr)0.7Non relativistic (l=1)E0.6<strong>Relativistic</strong> (=1)0.50.40.3Au 5pl=1j=1/2 (=1)0.2j=1-1/2=1/20.10.00.0 0.5 1.0 1.5 2.0r (bohr)2.5<strong>orbit</strong>almoment+e -e p 1/2 (=1): markedly different behavior than <strong>non</strong>-relativistic p-stateg =1 is <strong>non</strong>-zero at nucleus<strong>spin</strong>