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Commit 9f68fa1d authored by Johannes Wasmer's avatar Johannes Wasmer
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update classification-of-atomistic-ml_poster_2023-02-14

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fig/poster-2023-02-14/atomistic-ml/classification-of-atomistic-ml_poster_2023-02-14_ktikz.png

130 B | W: | H:

fig/poster-2023-02-14/atomistic-ml/classification-of-atomistic-ml_poster_2023-02-14_ktikz.png

130 B | W: | H:

fig/poster-2023-02-14/atomistic-ml/classification-of-atomistic-ml_poster_2023-02-14_ktikz.png
fig/poster-2023-02-14/atomistic-ml/classification-of-atomistic-ml_poster_2023-02-14_ktikz.png
fig/poster-2023-02-14/atomistic-ml/classification-of-atomistic-ml_poster_2023-02-14_ktikz.png
fig/poster-2023-02-14/atomistic-ml/classification-of-atomistic-ml_poster_2023-02-14_ktikz.png
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......@@ -169,7 +169,7 @@
\draw node[/box/active,v] (atoms) {Atomic Features\\\( A = \{ \vec{r}_i, a_i, \vec{G}, \vec{S}_i, \dots \}\)};
% \draw node[/box/active,v] (dft) [right=.7 of atoms] {\textit{Ab initio} method\\\textbf{KKR-GF} \faGears};
% \draw node[/box/active,v] (dft) [right=.7 of atoms] {\textbf{Simulator}\\\logoAiida -- KKRimp\,\logoKKRimpCircledXTwo};
\draw node[/box/active,v] (dft) [right=.7 of atoms] {{\footnotesize\textbf{First-Principles Simulator}}\\KKRimp\,\logoKKRimpCircledXTwo};
\draw node[/box/active,v] (dft) [right=.7 of atoms] {{\footnotesize\textbf{First-Principles Simulator}}\\\logoJuDFT Codes};
\draw node[/box/active,v] (primary) [right=.7 of dft] {Primary Output\\ \(V(\vec{r})\), \(n(\vec{r})\)};
\draw node[/box/active,v] (secondary) [right=.7 of primary] {Secondary Output\\ \(E_{tot}\), DOS, \(J_{ij}\)'s, \(\dots\)};
% E_tot ausgelassen; E(k) = bandstructure, D(E) = DOS
......@@ -180,12 +180,12 @@
\draw[/arr/active] (primary) -- (secondary);
\draw[/arr/active] (secondary) -- (tertiary);
%
\draw node[/box/ml,v] (representation) [below=.7 of atoms] {\textbf{Representation}\\\(\ket{A;\lambda\mu}\)};
\draw node[/box/ml,v] (representation) [below=.7 of atoms] {Representation\\\(\ket{A;\lambda\mu}\)};
% note: we draw surrogate-2 & env first cause need arrow rep-surr-2 to lie below surr-1
% surrogate-2 (secondary)
\draw node[/box/ml2,v] (surrogate-2) [below=.7 of secondary] {Secondary Emulator\\ \(J_{ij}\)'s \logoNeuralNetworkSolidCircledHelmholtzdarkblueBgWhite};
\draw node[/box/ml2,v] (surrogate-2) [below=.7 of secondary] {Secondary Emulator\\ {\footnotesize\textit{Magnetic properties}} \logoNeuralNetworkSolidCircledHelmholtzdarkblueBgWhite};
% \draw[/arr/active] (atoms) |- (surrogate);
\begin{scope}[transform canvas={yshift=-7}]
% shift arrow st surrogate input arrows not overlaid
......@@ -210,7 +210,7 @@
\draw[/arr/line] [color=mint] (surrogate-1) -- (primary);
%
\node[above=.7 of dft, minimum height=0] (dummypreserveheight) {}; % for arrow above in 6-kkr
\draw[/arr/ml] (primary.north) -- ++(0,.7) -| (dft) node[midway,right=-0.0,yshift=-10] {\textit{\textcolor{mint}{\logoAiida feedback}}};
\draw[/arr/ml] (primary.north) -- ++(0,.7) -| (dft) node[midway,right=0.3,yshift=-10] {\textit{\textcolor{mint}{\logoAiida feedback}}};
%
%\draw[/arr/active] (primary) -- (surrogate-2) node[midway,right=-2.3,yshift=19,rotate=-22.5] {\textit{train}};
\begin{scope}[transform canvas={xshift=-0}]
......
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