Initinal commit /lps-lii-ps4-iodide-geometry

2026-08-07 14:45:01 +09:00
commit d8e27d06b0
9 changed files with 3414171 additions and 0 deletions
@@ -0,0 +1,20 @@
+# Ignore everything by default.
+*
+
+# Keep repository documentation and Git settings.
+!.gitignore
+!README.org
+
+# Keep analysis scripts.
+!dump2cube_edge_corner.py
+!cube2mayavi_edge_corner.py
+
+# Keep the selected example trajectory.
+!050Li3PS4-050LiI_thin100.lammpstrj
+
+# Keep the selected example cube files.
+!050Li3PS4-050LiI_PS4_I_All.cube
+!050Li3PS4-050LiI_PS4_I_zero.cube
+!050Li3PS4-050LiI_PS4_I_corner.cube
+!050Li3PS4-050LiI_PS4_I_edge.cube
+!050Li3PS4-050LiI_PS4_I_three.cube