diff --git a/lepaper/infinite.lyx b/lepaper/infinite.lyx index 1485270..c882b8f 100644 --- a/lepaper/infinite.lyx +++ b/lepaper/infinite.lyx @@ -953,8 +953,8 @@ literal "false" basic idea can be used as well, resulting in exponentially convergent summation formulae, but the technical details are considerably more complicated than in electrostatics. - For the scalar Helmholtz equation in three dimensions, the formulae were - developed by Ham & Segall + For the scalar Helmholtz equation in three dimensions, the formulae for + lattice Green's functions were developed by Ham & Segall \begin_inset CommandInset citation LatexCommand cite key "ham_energy_1961" @@ -988,10 +988,28 @@ literal "false" \end_inset . - We will not rederive the formulae here, but for reference, we restate the - results in a form independent upon the normalisation and phase conventions - for spherical harmonic bases (pointing out some errors in the aforementioned - literature) and discuss some practical aspects of the numerical evaluation. + +\end_layout + +\begin_layout Standard +For our purposes we do not need directly the lattice Green's functions but + rather the related lattice sums of spherical wavefunctions defined in +\begin_inset CommandInset ref +LatexCommand eqref +reference "eq:sigma lattice sums" +plural "false" +caps "false" +noprefix "false" + +\end_inset + +, which can be derived by an analogous procedure. + Below, we state the results in a form independent upon the normalisation + and phase conventions for spherical harmonic bases (pointing out some errors + in the aforementioned literature) and discuss some practical aspects of + the numerical evaluation. + The derivation of the somewhat more complicated 1D and 2D periodicities + is provided in the Supplementary Material. \begin_inset Note Note status open @@ -1001,7 +1019,7 @@ Tady ještě upřesnit, co vlastně dělám. \end_inset - + \end_layout \begin_layout Standard diff --git a/lepaper/symmetries.lyx b/lepaper/symmetries.lyx index 4b8beaa..90f1fc4 100644 --- a/lepaper/symmetries.lyx +++ b/lepaper/symmetries.lyx @@ -596,6 +596,10 @@ noprefix "false" \end_inset , we have +\begin_inset Note Note +status open + +\begin_layout Plain Layout \begin_inset Marginal status open @@ -607,6 +611,11 @@ Check this carefully. \end_inset +\end_layout + +\end_inset + + \begin_inset Formula \begin{multline} \left(\groupop g\vect E\right)\left(\omega,\vect r\right)=\sum_{\tau=1,2}\sum_{l=1}^{\infty}\sum_{m=-l}^{+l}\sum_{m'=-l}^{l}\left(\rcoeffptlm p{\tau}lmD_{m',\mu'}^{\tau l}\left(g\right)\vswfrtlm{\tau}l{m'}\left(\kappa\left(\vect r-R_{g}\vect r_{p}\right)\right)\right.+\\