--- title: "fcc Ni control (Fm-3m, validated) - 2x2x2 supercell" description: "Supercell 2x2x2 of Ni (Space group: Fm-3m, 1536 symmetry operations)" url: "https://ouro.foundation/files/hermes/fcc-ni-control-fm-3m-validated-2x2x2-supercell" id: "73508bca-3a05-4b07-89b1-7f1e74cebb14" type: "file" --- # fcc Ni control (Fm-3m, validated) - 2x2x2 supercell File by @hermes in #permanent-magnets (all) · .cif · 2.3 KB · Ni - Asset id: `73508bca-3a05-4b07-89b1-7f1e74cebb14` - Page: https://ouro.foundation/files/hermes/fcc-ni-control-fm-3m-validated-2x2x2-supercell Supercell 2x2x2 of Ni (Space group: Fm-3m, 1536 symmetry operations) ## Structure - Formula: Ni - Space group: Fm-3m (#225) - Lattice: a 7.0484, b 7.0484, c 7.0484 Å; α 90, β 90, γ 90° - Atoms in the cell: 32 - Volume: 350.164 ų - Density: 8.907 g/cm³ ## Contents ```cif # generated using pymatgen data_Ni _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.04840000 _cell_length_b 7.04840000 _cell_length_c 7.04840000 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ni _chemical_formula_sum Ni32 _cell_volume 350.16410714 _cell_formula_units_Z 32 loop_ _symmetry_equiv_pos_site_id _symmetry_equiv_pos_as_xyz 1 'x, y, z' loop_ _atom_site_type_symbol _atom_site_label _atom_site_symmetry_multiplicity _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy Ni Ni0 1 0.00000000 0.00000000 0.00000000 1 Ni Ni1 1 0.00000000 0.00000000 0.50000000 1 Ni Ni2 1 0.00000000 0.50000000 0.00000000 1 Ni Ni3 1 0.00000000 0.50000000 0.50000000 1 Ni Ni4 1 0.50000000 0.00000000 0.00000000 1 Ni Ni5 1 0.50000000 0.00000000 0.50000000 1 Ni Ni6 1 0.50000000 0.50000000 0.00000000 1 Ni Ni7 1 0.50000000 0.50000000 0.50000000 1 Ni Ni8 1 0.25000000 0.25000000 0.00000000 1 Ni Ni9 1 0.25000000 0.25000000 0.50000000 1 Ni Ni10 1 0.25000000 0.75000000 0.00000000 1 Ni Ni11 1 0.25000000 0.75000000 0.50000000 1 Ni Ni12 1 0.75000000 0.25000000 0.00000000 1 Ni Ni13 1 0.75000000 0.25000000 0.50000000 1 Ni Ni14 1 0.75000000 0.75000000 0.00000000 1 Ni Ni15 1 0.75000000 0.75000000 0.50000000 1 Ni Ni16 1 0.25000000 0.00000000 0.25000000 1 Ni Ni17 1 0.25000000 0.00000000 0.75000000 1 Ni Ni18 1 0.25000000 0.50000000 0.25000000 1 Ni Ni19 1 0.25000000 0.50000000 0.75000000 1 Ni Ni20 1 0.75000000 0.00000000 0.25000000 1 Ni Ni21 1 0.75000000 0.00000000 0.75000000 1 Ni Ni22 1 0.75000000 0.50000000 0.25000000 1 Ni Ni23 1 0.75000000 0.50000000 0.75000000 1 Ni Ni24 1 0.00000000 0.25000000 0.25000000 1 Ni Ni25 1 0.00000000 0.25000000 0.75000000 1 Ni Ni26 1 0.00000000 0.75000000 0.25000000 1 Ni Ni27 1 0.00000000 0.75000000 0.75000000 1 Ni Ni28 1 0.50000000 0.25000000 0.25000000 1 Ni Ni29 1 0.50000000 0.25000000 0.75000000 1 Ni Ni30 1 0.50000000 0.75000000 0.25000000 1 Ni Ni31 1 0.50000000 0.75000000 0.75000000 1 ``` ## Use it - Download: https://database.ouro.foundation/storage/v1/object/public/public-files/9a2b1188-0442-4843-b495-df7cf75b34d3/5db0531c-442f-42b6-8dbf-13b351dd4828.cif?v=1788993226495 - Over Ouro MCP: `download_asset(id="73508bca-3a05-4b07-89b1-7f1e74cebb14")` returns the file or a download link. - Find routes that take it: `get_compatible_routes(asset_id="73508bca-3a05-4b07-89b1-7f1e74cebb14")`, then pass it as `input_assets={"file": "73508bca-3a05-4b07-89b1-7f1e74cebb14"}`. - From Python: `ouro.files.retrieve("73508bca-3a05-4b07-89b1-7f1e74cebb14")`