Update test files

WMD-group · Aug 30, 2024 · 9125edb · 9125edb
1 parent b8982be
commit 9125edb
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Showing 2 changed files with 8 additions and 8 deletions.
diff --git a/smact/tests/files/test_icsd_oxidation_states_filter_1000.txt b/smact/tests/files/test_icsd_oxidation_states_filter_1000.txt
@@ -7,7 +7,7 @@
 H -1 1
 He
 Li 1
-Be
+Be 2
 B 3
 C -2 2 3 4
 N -3 5
@@ -26,7 +26,7 @@ K 1
 Ca 2
 Sc 3
 Ti 4
-V 4 5
+V 3 4 5
 Cr 3
 Mn 2 3 4
 Fe 2 3

diff --git a/smact/tests/files/test_icsd_oxidation_states_filter_1000_w_0_ox_state.txt b/smact/tests/files/test_icsd_oxidation_states_filter_1000_w_0_ox_state.txt
@@ -9,7 +9,7 @@
 H -1 0 1
 He
 Li 0 1
-Be
+Be 2
 B 0 3
 C -2 0 2 3 4
 N -3 0 5
@@ -28,7 +28,7 @@ K 1
 Ca 0 2
 Sc 0 3
 Ti 0 4
-V 0 4 5
+V 0 3 4 5
 Cr 0 3
 Mn 0 2 3 4
 Fe 0 2 3
@@ -38,7 +38,7 @@ Cu 0 1 2
 Zn 0 2
 Ga 0 3
 Ge 0 4
-As -3 3 5
+As -3 0 3 5
 Se -2 0 4
 Br -1
 Kr
@@ -52,7 +52,7 @@ Tc
 Ru 0
 Rh 0
 Pd 0
-Ag 1
+Ag 0 1
 Cd 0 2
 In 0 3
 Sn 0 2 4
@@ -82,13 +82,13 @@ Ta 0 5
 W 6
 Re
 Os
-Ir
+Ir 0
 Pt 0
 Au 0
 Hg 2
 Tl 1
 Pb 2
-Bi 3
+Bi 0 3
 Po
 At
 Rn
-Original file line number
+Diff line change
@@ Expand Up / @@ -7,7 +7,7 @@ @@
     H -1 1
     He
     Li 1
-    Be
+    Be 2
     B 3
     C -2 2 3 4
     N -3 5
@@ Expand All / @@ -26,7 +26,7 @@ K 1 @@
     Ca 2
     Sc 3
     Ti 4
-    V 4 5
+    V 3 4 5
     Cr 3
     Mn 2 3 4
     Fe 2 3
@@ Expand Down @@