diff --git a/Doc/tutorials/basic/basic_012.ipynb b/Doc/tutorials/basic/basic_012.ipynb index 6484e90..4ee448e 100644 --- a/Doc/tutorials/basic/basic_012.ipynb +++ b/Doc/tutorials/basic/basic_012.ipynb @@ -196,7 +196,7 @@ "Bohr2Angstrom = 0.529177\n", "\n", "# extract atomic coordinates\n", - "atomic_structure = root.find('input/atomic_structure')\n", + "atomic_structure = root.find('output/atomic_structure')\n", "alat = float(atomic_structure.attrib['alat'])\n", "atoms = atomic_structure.findall('atomic_positions/atom')\n", "gs_geo = [np.array(atom.text.split(), dtype=np.float64) * Bohr2Angstrom for atom in atoms]" @@ -639,7 +639,7 @@ "\n", "xmlData = ET.parse(fname)\n", "root = xmlData.getroot()\n", - "atomic_structure = root.find('input/atomic_structure')\n", + "atomic_structure = root.find('output/atomic_structure')\n", "alat = float(atomic_structure.attrib['alat'])\n", "atoms = atomic_structure.findall('atomic_positions/atom')\n", "es_geo = [np.array(atom.text.split(), dtype=np.float64) * Bohr2Angstrom for atom in atoms]"