add description and equations of planar and macroscopic averages to t…

…he Ionisation potential tutorial. Also add more detailed description for the lattice_parameter
WMD-group · Dec 24, 2023 · 291b025 · 291b025
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diff --git a/docs/tutorials.rst b/docs/tutorials.rst
@@ -4,7 +4,6 @@ Tutorials
 .. toctree::
    :maxdepth: 2
 
-   tutorials/MD_workbook.ipynb
    tutorials/Slab/SlabCalculation.ipynb
    tutorials/Porous/Porous.ipynb
    tutorials/Band_Alignment/Band_Alignment.ipynb
diff --git a/docs/tutorials/Slab/Bi2O3_bulk.poscar b/docs/tutorials/Slab/Bi2O3_bulk.poscar
@@ -0,0 +1,28 @@
+Bi8 O12
+1.0
+   0.0000000000000000    5.8719874985375471    0.0000000000000000
+   8.1153126200000631    0.0000000000000000    0.0000000000000000
+   0.0000000000000000   -2.8476311555282727   -6.8814245744924971
+Bi O
+8 12
+direct
+   0.4603389099999999    0.5433417500000000    0.2237906900000000 Bi3+
+   0.5396610900000001    0.0433417500000000    0.2762093100000000 Bi3+
+   0.5396610900000001    0.4566582500000000    0.7762093100000000 Bi3+
+   0.4603389099999999    0.9566582500000000    0.7237906900000000 Bi3+
+   0.9772694499999999    0.6867247800000000    0.6330357300000000 Bi3+
+   0.0227305500000001    0.1867247800000000    0.8669642700000000 Bi3+
+   0.0227305500000001    0.3132752200000000    0.3669642700000000 Bi3+
+   0.9772694499999999    0.8132752200000000    0.1330357300000000 Bi3+
+   0.2297177399999999    0.5317887700000000    0.4885077499999999 O2-
+   0.7702822600000001    0.0317887700000000    0.0114922500000001 O2-
+   0.7702822600000001    0.4682112300000000    0.5114922500000001 O2-
+   0.2297177399999999    0.9682112300000000    0.9885077499999999 O2-
+   0.2642227299999999    0.5506067299999999    0.8756554499999998 O2-
+   0.7357772700000001    0.0506067299999999    0.6243445500000002 O2-
+   0.7357772700000001    0.4493932700000001    0.1243445500000002 O2-
+   0.2642227299999999    0.9493932700000001    0.3756554499999998 O2-
+   0.7223329099999998    0.7031440000000000    0.7918742799999998 O2-
+   0.2776670900000002    0.2031440000000000    0.7081257200000002 O2-
+   0.2776670900000002    0.2968560000000000    0.2081257200000002 O2-
+   0.7223329099999998    0.7968560000000000    0.2918742799999998 O2-
diff --git a/docs/tutorials/Slab/SlabCalculation.ipynb b/docs/tutorials/Slab/SlabCalculation.ipynb