diff --git a/doc/src/pair_sw.rst b/doc/src/pair_sw.rst index c515428819..58df0fa200 100644 --- a/doc/src/pair_sw.rst +++ b/doc/src/pair_sw.rst @@ -94,12 +94,12 @@ used in the original energy and force expression is scaled by a switching factor 0 & \vert \delta \rvert > \delta_2 \end{array} \right. \\ -This cut-off function decreases smoothly from 1 to 0 over the range [`delta_1`, `delta_2`]. -This smoothly turns off the energy and force contributions for `\lvert \delta \rvert > deltai_2`. -It is suggested that `delta_1` and `delta_2` to be the value around -`0.5 \lvert \cos \left( \theta_1 \right) - \cos \left( \theta_2 \right) \rvert`, -with `theta_1` and `theta_2` as the different types of angles around an atom. -For borophene and transition metal dichalcogenide, `\delta_1 = 0.25` and `\delta_2 = 0.35`. +This cut-off function decreases smoothly from 1 to 0 over the range :math:[\delta_1, \delta_2]. +This smoothly turns off the energy and force contributions for :math:\lvert \delta \rvert > \delta_2. +It is suggested that :math:\delta_1 and :math:\delta_2 to be the value around +:math:0.5 \lvert \cos \theta_1 - \cos \theta_2 \rvert, with +:math:\theta_1 and :math:\theta_2 as the different types of angles around an atom. +For borophene and transition metal dichalcogenide, :math:\delta_1 = 0.25 and :math:\delta_2 = 0.35. This value enables the cut-off function to exclude unnecessary angles in the three-body SW terms. .. note::