update

shahramyalameha · Aug 31, 2022 · 18f1584 · 18f1584
1 parent 33e089d
commit 18f1584
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Showing 8 changed files with 2,754 additions and 17 deletions.
diff --git a/db/plotly.js b/db/plotly.js
diff --git a/example/Cubic_bulk/README b/example/Cubic_bulk/README
@@ -7,5 +7,7 @@ Cij:
         0.000000     0.000000     0.000000    59.400000     0.000000     0.000000
         0.000000     0.000000     0.000000     0.000000    59.400000     0.000000
         0.000000     0.000000     0.000000     0.000000     0.000000    59.400000
- run: EaTools
+ run: EaTools.x
    select:  > 3 > 5 > N 
+ command-line:
+      EaTools.x -d 3 -m 5 -ewp n
diff --git a/example/MP-ID/README b/example/MP-ID/README
@@ -1,6 +1,8 @@
 MATERIAL: Cu2WS4 Materials Project id :   mp-557373
- run: EaTools_lapw
+ run: EaTools.x 
   select:  > 3 > 6 > N> mp-557373
-
+
+  command-line:
+      EaTools.x -d 3 -m 6 
 
 
diff --git a/example/Orthorhombic_bulk/README b/example/Orthorhombic_bulk/README
@@ -7,7 +7,8 @@ Cij:
        0.000000     0.000000     0.000000    40.000000     0.000000     0.000000
        0.000000     0.000000     0.000000     0.000000    26.000000     0.000000
        0.000000     0.000000     0.000000     0.000000     0.000000     38.000000
- run: EaTools 
+ run: EaTools.x 
    select:  > 3 > 5 > N 
 
-
+ command-line:
+      EaTools.x -d 3 -m 5 -ewp n
diff --git a/example/SiO_monolayer/README b/example/SiO_monolayer/README
@@ -9,5 +9,8 @@ Cij:
  run: EaTools.x 
  select:  > 2 > 2 
 
+ command-line:
+      EaTools.x -d 2 -m 2  
+
 
 
diff --git a/example/Tetragonal_bulk/README b/example/Tetragonal_bulk/README
@@ -10,5 +10,6 @@ Cij:
  run: EaTools.x
   select:  > 3 > 5 > N 
 
-
+  command-line:
+      EaTools.x -d 3 -m 5 -ewp n
 
diff --git a/example/usergouid.pdf b/example/usergouid.pdf
diff --git a/soc/Eatools_main.i90 b/soc/Eatools_main.i90