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Merged
merged 2 commits into from
Jan 25, 2025
Merged

fix/import 2 #204

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0a78898
chore: fix typo
VsevolodX Jan 24, 2025
7b692d6
chore: reduce the size of nanoribbon (100 A = 40 unit cells)
VsevolodX Jan 24, 2025
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18 changes: 9 additions & 9 deletions ...ials_designer/specific_examples/interface_bilayer_twisted_nanoribbons_boron_nitride.ipynb
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Original file line number Diff line number Diff line change
Expand Up @@ -42,16 +42,15 @@
},
{
"cell_type": "code",
"outputs": [],
"source": [
"# Material and structure parameters\n",
"TWIST_ANGLE_A = 2.64 # Twist angle in degrees for A material\n",
"TWIST_ANGLE_B = 60 + 2.64 # Twist angle in degrees for B material\n",
"\n",
"# Nanoribbons parameters\n",
"\n",
"RIBBON_WIDTH = 100 # Width of the nanoribbon in Angstroms\n",
"RIBBON_LENGTH = 100 # Length of the nanoribbon in Angstrom\n",
"RIBBON_WIDTH = 40 # Width of the nanoribbon in unit cells\n",
"RIBBON_LENGTH = 40 # Length of the nanoribbon in unit cells\n",
"\n",
"# Interface parameters\n",
"INTERFACE_DISTANCE = 3.23 # Distance between layers in Angstroms\n",
Expand All @@ -65,6 +64,7 @@
"collapsed": false
},
"id": "47af0a587ce80b91",
"outputs": [],
"execution_count": null
},
{
Expand All @@ -79,7 +79,6 @@
},
{
"cell_type": "code",
"outputs": [],
"source": [
"import sys\n",
"\n",
Expand All @@ -95,6 +94,7 @@
"collapsed": false
},
"id": "f67b53c0f60f257c",
"outputs": [],
"execution_count": null
},
{
Expand All @@ -110,7 +110,6 @@
},
{
"cell_type": "code",
"outputs": [],
"source": [
"from mat3ra.made.material import Material\n",
"from mat3ra.standata.materials import Materials\n",
Expand All @@ -130,6 +129,7 @@
"collapsed": false
},
"id": "f1c2ac4b7553961b",
"outputs": [],
"execution_count": null
},
{
Expand All @@ -145,7 +145,6 @@
},
{
"cell_type": "code",
"outputs": [],
"source": [
"from mat3ra.made.tools.build.interface.builders import NanoRibbonTwistedInterfaceBuilder\n",
"from mat3ra.made.tools.build.interface.configuration import NanoRibbonTwistedInterfaceConfiguration\n",
Expand Down Expand Up @@ -174,6 +173,7 @@
"collapsed": false
},
"id": "80ac5dd96d8622b7",
"outputs": [],
"execution_count": null
},
{
Expand All @@ -188,7 +188,6 @@
},
{
"cell_type": "code",
"outputs": [],
"source": [
"interface_a = builder.get_material(config_a)\n",
"interface_b = builder.get_material(config_b)\n",
Expand All @@ -203,6 +202,7 @@
"collapsed": false
},
"id": "10f0a8aac5fec58f",
"outputs": [],
"execution_count": null
},
{
Expand All @@ -217,7 +217,6 @@
},
{
"cell_type": "code",
"outputs": [],
"source": [
"visualize_materials([interface_a, interface_b], repetitions=VISUALIZE_REPETITIONS)\n",
"visualize_materials([interface_a, interface_b], repetitions=VISUALIZE_REPETITIONS, rotation=\"-90x\")"
Expand All @@ -226,6 +225,7 @@
"collapsed": false
},
"id": "c4049a69b2dcbaa1",
"outputs": [],
"execution_count": null
},
{
Expand All @@ -240,7 +240,6 @@
},
{
"cell_type": "code",
"outputs": [],
"source": [
"from utils.jupyterlite import download_content_to_file, set_materials\n",
"\n",
Expand All @@ -252,6 +251,7 @@
"collapsed": false
},
"id": "a64a81bb1ab4d47d",
"outputs": [],
"execution_count": null
}
],
Expand Down
2 changes: 1 addition & 1 deletion other/materials_designer/specific_examples/perturbation_ripple_graphene.ipynb
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Original file line number Diff line number Diff line change
Expand Up @@ -57,7 +57,7 @@
" await micropip.install('mat3ra-api-examples', deps=False)\n",
" from utils.jupyterlite import install_packages\n",
"\n",
" await install_packages(\"specific-examples\")"
" await install_packages(\"specific_examples\")"
],
"metadata": {
"collapsed": false
Expand Down
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