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| physics_chemistry:orbitals:k [2016/10/10 09:40] – external edit 127.0.0.1 | physics_chemistry:orbitals:k [2026/06/20 16:13] (current) – Maurits W. Haverkort | ||
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| ====== Kubic Harmonics (K) ====== | ====== Kubic Harmonics (K) ====== | ||
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| - | The relation between the kubic harmonics and the tesseral harmonics is given by the matrix $T_{Z\, | + | The relation between the kubic harmonics and the tesseral harmonics is given by the matrix $T_{Z\, |
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| The following table shows the kubic harmonics up to $l=6$. We list the explicit function in terms of the directional cosines $x$, $y$ and $z$. The plots show the surface defined by the equation $r={K_l^{(m)}}^* K_l^{(m)}$. The color of the surface is according to the phase with red for positive and cyan for negative. We show a 3D image as well as a projection along the $x$, $y$ and $z$ direction. | The following table shows the kubic harmonics up to $l=6$. We list the explicit function in terms of the directional cosines $x$, $y$ and $z$. The plots show the surface defined by the equation $r={K_l^{(m)}}^* K_l^{(m)}$. The color of the surface is according to the phase with red for positive and cyan for negative. We show a 3D image as well as a projection along the $x$, $y$ and $z$ direction. | ||
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| ====== Different orbital basis sets used ====== | ====== Different orbital basis sets used ====== | ||
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