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1 parent c7dea1c commit 1e14979Copy full SHA for 1e14979
notebooks/sqs_demo.ipynb
@@ -16,7 +16,7 @@
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"source": [
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"from pymatgen.core import Structure\n",
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"from pymatgen.analysis.structure_matcher import StructureMatcher\n",
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- "s1 = Structure.from_file('../examples/POSCAR_CoBHT')\n",
+ "s1 = Structure.from_file('../examples/POSCAR')\n",
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"s2 = Structure.from_file('../examples/POSCAR_substituted')\n",
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"matcher = StructureMatcher()\n",
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"score = matcher.get_rms_dist(s1, s2)\n",
@@ -37,4 +37,4 @@
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},
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"nbformat": 4,
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"nbformat_minor": 5
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-}
+}
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