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mlip-playground

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ManasSharma07 commited on Jun 10

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0037cab

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1 Parent(s): 37e7303

Update src/streamlit_app.py

Files changed (1) hide show

src/streamlit_app.py CHANGED Viewed

@@ -613,6 +613,7 @@ SAMPLE_STRUCTURES = {
     "Caffeine": "caffeine.xyz",
     "Ibuprofen": "ibuprofen.xyz",
     "Silicon": "Si.cif",
 }
 def get_structure_viz2(atoms_obj, style='stick', show_unit_cell=True, width=400, height=400):

     "Caffeine": "caffeine.xyz",
     "Ibuprofen": "ibuprofen.xyz",
     "Silicon": "Si.cif",
+    "hBN Monolayer (4x4)": "hBN_monolayer_4x4_supercell.extxyz",
 }
 def get_structure_viz2(atoms_obj, style='stick', show_unit_cell=True, width=400, height=400):