(PL) added the simple cubic SC prototype of elemental Po

ricardonpa · Apr 26, 2024 · b3bec04 · b3bec04
1 parent 66eb23c
commit b3bec04
Showing 1 changed file with 12 additions and 0 deletions.
diff --git a/pysipfenn/misc/prototypeLibrary.yaml b/pysipfenn/misc/prototypeLibrary.yaml
@@ -76,3 +76,15 @@
     Direct
       0.00000   0.00000   0.00000
       0.75000   0.25000   0.50000
+- name: SC
+  origin: http://crystallography.net/cod/1512532.html
+  POSCAR: |
+    Po1
+    1.0
+      3.345000 0.000000 0.000000
+      0.000000 3.345000 0.000000
+      0.000000 0.000000 3.345000
+    Po
+    1
+    direct
+      0.000000 0.000000 0.000000