Add get_result.sh

examples/PinnedH2O/get_result.sh

@@ -0,0 +1,27 @@
+filename="offline_PinnedH2O.out" # FOM
+#filename="rom39_PinnedH2O.out" # compare MD
+#filename="39_force_PinnedH2O.out" # compare force
+
+# Extracting H1, H2, F1, F2 from MGmgol output log
+# if FOM, these files contain the FOM results
+# if compare MD, these files contain the results with projected orbitals
+awk '/H1 / {print $3, $4, $5}' $filename > H1_$filename
+awk '/H2 / {print $3, $4, $5}' $filename > H2_$filename
+awk '/F1 / {print $6, $7, $8}' $filename > F1_$filename
+awk '/F2 / {print $6, $7, $8}' $filename > F2_$filename
+
+# if compare force, files with "_fom" contain the FOM results
+# files with "_rom" contain the results with projected orbitals
+if [[ "$filename" == *"force_"* ]]; then
+    sed -n '1~2p' H1_$filename > H1_rom$filename
+    sed -n '1~2p' H2_$filename > H2_rom$filename
+    sed -n '1~2p' F1_$filename > F1_rom$filename
+    sed -n '1~2p' F2_$filename > F2_rom$filename
+
+    sed -n '2~2p' H1_$filename > H1_fom$filename
+    sed -n '2~2p' H2_$filename > H2_fom$filename
+    sed -n '2~2p' F1_$filename > F1_fom$filename
+    sed -n '2~2p' F2_$filename > F2_fom$filename
+fi
+
+rm -rf snapshot0_*