GET /third-parties/MatprojStructure/?format=api&ordering=structure_string&page=12115
HTTP 200 OK
Allow: GET, HEAD, OPTIONS
Content-Type: application/json
Vary: Accept

{
    "count": 146323,
    "next": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=structure_string&page=12116",
    "previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=structure_string&page=12114",
    "results": [
        {
            "id": "mp-485",
            "created_at": "2022-09-04T14:41:54.781249Z",
            "structure_string": "Zr2 Ni6\n1.0\n2.657819 -4.603477 0.000000\n2.657819 4.603477 0.000000\n0.000000 0.000000 4.305186\nZr Ni\n2 6\ndirect\n0.666667 0.333333 0.750000 Zr\n0.333333 0.666667 0.250000 Zr\n0.155709 0.311419 0.750000 Ni\n0.844291 0.155709 0.250000 Ni\n0.844291 0.688581 0.250000 Ni\n0.155709 0.844291 0.750000 Ni\n0.688581 0.844291 0.750000 Ni\n0.311419 0.155709 0.250000 Ni\n",
            "nsites": 8,
            "nelements": 2,
            "elements": [
                "Zr",
                "Ni"
            ],
            "chemical_system": "Ni-Zr",
            "density": 8.426584523462969,
            "density_atomic": 0.07593756947158822,
            "volume": 105.34969785928126,
            "volume_molar": 7.93038386915078,
            "formula_full": "Zr2 Ni6",
            "formula_reduced": "ZrNi3",
            "formula_anonymous": "AB3",
            "energy": -55.44386553,
            "energy_per_atom": -6.93048319125,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -55.44386553,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0005354,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:35:28.805000Z",
            "spacegroup": 194
        },
        {
            "id": "mp-2717",
            "created_at": "2022-09-04T14:48:25.503817Z",
            "structure_string": "Zr2 Ni7\n1.0\n4.115872 2.345614 0.000000\n-4.115872 2.345614 0.000000\n0.000000 1.739334 6.044204\nZr Ni\n2 7\ndirect\n0.607089 0.607089 0.228293 Zr\n0.392911 0.392911 0.771707 Zr\n0.000000 0.000000 0.500000 Ni\n0.292345 0.960625 0.156409 Ni\n0.039375 0.707655 0.843591 Ni\n0.707655 0.039375 0.843591 Ni\n0.960625 0.292345 0.156409 Ni\n0.500000 0.000000 0.500000 Ni\n0.000000 0.500000 0.500000 Ni\n",
            "nsites": 9,
            "nelements": 2,
            "elements": [
                "Zr",
                "Ni"
            ],
            "chemical_system": "Ni-Zr",
            "density": 8.441842565039996,
            "density_atomic": 0.07711786445987345,
            "volume": 116.70447649238196,
            "volume_molar": 7.809008719547058,
            "formula_full": "Zr2 Ni7",
            "formula_reduced": "Zr2Ni7",
            "formula_anonymous": "A2B7",
            "energy": -61.4021126,
            "energy_per_atom": -6.822456955555555,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -61.4021126,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0004994,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:39:12.104000Z",
            "spacegroup": 12
        },
        {
            "id": "mp-1104853",
            "created_at": "2022-09-04T14:46:55.014783Z",
            "structure_string": "Zr2 Ni8 As4\n1.0\n7.083152 0.000000 0.000000\n0.000000 7.083152 0.000000\n0.000000 0.000000 3.755067\nZr Ni As\n2 8 4\ndirect\n0.500000 0.500000 0.000000 Zr\n0.000000 0.000000 0.500000 Zr\n0.590199 0.154575 0.500000 Ni\n0.409801 0.845425 0.500000 Ni\n0.090199 0.345425 0.000000 Ni\n0.909801 0.654575 0.000000 Ni\n0.154575 0.590199 0.500000 Ni\n0.845425 0.409801 0.500000 Ni\n0.345425 0.090199 0.000000 Ni\n0.654575 0.909801 0.000000 Ni\n0.716963 0.716963 0.500000 As\n0.283037 0.283037 0.500000 As\n0.216963 0.783037 0.000000 As\n0.783037 0.216963 0.000000 As\n",
            "nsites": 14,
            "nelements": 3,
            "elements": [
                "Zr",
                "Ni",
                "As"
            ],
            "chemical_system": "As-Ni-Zr",
            "density": 8.38822278751339,
            "density_atomic": 0.07431170437480665,
            "volume": 188.3956251277466,
            "volume_molar": 8.103892664910592,
            "formula_full": "Zr2 Ni8 As4",
            "formula_reduced": "Zr(Ni2As)2",
            "formula_anonymous": "AB2C4",
            "energy": -89.66754864,
            "energy_per_atom": -6.404824902857143,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -89.66754864,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 0.8710251,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:37:49.433000Z",
            "spacegroup": 136
        },
        {
            "id": "mp-1246335",
            "created_at": "2022-09-04T14:39:05.410420Z",
            "structure_string": "Zr2 Ni8 N8\n1.0\n5.444756 0.434753 -0.057204\n2.470475 5.171972 0.358820\n1.532869 2.804804 7.363515\nZr Ni N\n2 8 8\ndirect\n0.762114 0.740416 0.806210 Zr\n0.237886 0.259584 0.193790 Zr\n0.657273 0.664167 0.216276 Ni\n0.342727 0.335833 0.783724 Ni\n0.797603 0.173046 0.915342 Ni\n0.202397 0.826954 0.084658 Ni\n0.726867 0.481667 0.553240 Ni\n0.273133 0.518333 0.446760 Ni\n0.216998 0.950267 0.616662 Ni\n0.783002 0.049733 0.383338 Ni\n0.050740 0.737437 0.588503 N\n0.949260 0.262564 0.411497 N\n0.908330 0.772529 0.029363 N\n0.091670 0.227471 0.970637 N\n0.537029 0.547040 0.765080 N\n0.462971 0.452960 0.234920 N\n0.608372 0.859563 0.363283 N\n0.391628 0.140437 0.636717 N\n",
            "nsites": 18,
            "nelements": 3,
            "elements": [
                "Zr",
                "Ni",
                "N"
            ],
            "chemical_system": "N-Ni-Zr",
            "density": 6.530929078211935,
            "density_atomic": 0.0926567957296573,
            "volume": 194.2652976314679,
            "volume_molar": 6.499405372888857,
            "formula_full": "Zr2 Ni8 N8",
            "formula_reduced": "Zr(NiN)4",
            "formula_anonymous": "AB4C4",
            "energy": -133.99934766,
            "energy_per_atom": -7.444408203333334,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -131.11134766,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.000672,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:34:29.395000Z",
            "spacegroup": 2
        },
        {
            "id": "mp-505598",
            "created_at": "2022-09-04T14:41:00.199346Z",
            "structure_string": "Zr2 Ni8 P4\n1.0\n6.928404 0.000000 0.000000\n0.000000 6.928404 0.000000\n0.000000 0.000000 3.583177\nZr Ni P\n2 8 4\ndirect\n0.000000 0.000000 0.500000 Zr\n0.500000 0.500000 0.000000 Zr\n0.334841 0.085147 0.000000 Ni\n0.585147 0.165159 0.500000 Ni\n0.414853 0.834841 0.500000 Ni\n0.665159 0.914853 0.000000 Ni\n0.165159 0.585147 0.500000 Ni\n0.834841 0.414853 0.500000 Ni\n0.085147 0.334841 0.000000 Ni\n0.914853 0.665159 0.000000 Ni\n0.780459 0.219541 0.000000 P\n0.719541 0.719541 0.500000 P\n0.280459 0.280459 0.500000 P\n0.219541 0.780459 0.000000 P\n",
            "nsites": 14,
            "nelements": 3,
            "elements": [
                "Zr",
                "Ni",
                "P"
            ],
            "chemical_system": "Ni-P-Zr",
            "density": 7.49056749301416,
            "density_atomic": 0.08139418265135939,
            "volume": 172.00246435260667,
            "volume_molar": 7.398736081416283,
            "formula_full": "Zr2 Ni8 P4",
            "formula_reduced": "Zr(Ni2P)2",
            "formula_anonymous": "AB2C4",
            "energy": -96.27011321,
            "energy_per_atom": -6.876436657857143,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -96.27011321,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.001588,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:35:11.411000Z",
            "spacegroup": 136
        },
        {
            "id": "mp-12707",
            "created_at": "2022-09-04T14:45:39.701923Z",
            "structure_string": "Zr2 Np1\n1.0\n2.617336 -4.533360 0.000000\n2.617336 4.533360 0.000000\n0.000000 0.000000 2.811501\nZr Np\n2 1\ndirect\n0.666667 0.333333 0.500000 Zr\n0.333333 0.666667 0.500000 Zr\n0.000000 0.000000 0.000000 Np\n",
            "nsites": 3,
            "nelements": 2,
            "elements": [
                "Zr",
                "Np"
            ],
            "chemical_system": "Np-Zr",
            "density": 10.439490428203017,
            "density_atomic": 0.0449648687153381,
            "volume": 66.71875367839473,
            "volume_molar": 13.39299086610203,
            "formula_full": "Zr2 Np1",
            "formula_reduced": "Zr2Np",
            "formula_anonymous": "AB2",
            "energy": -28.41561922,
            "energy_per_atom": -9.471873073333333,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -28.41561922,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 0.3002716,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:37:07.605000Z",
            "spacegroup": 191
        },
        {
            "id": "mp-754403",
            "created_at": "2022-09-04T14:41:04.757056Z",
            "structure_string": "Zr2 O4\n1.0\n-2.031493 2.031493 5.392588\n2.031493 -2.031493 5.392588\n2.031493 2.031493 -5.392588\nZr O\n2 4\ndirect\n0.000000 0.000000 0.000000 Zr\n0.750000 0.250000 0.500000 Zr\n0.798211 0.798211 0.000000 O\n0.201789 0.201789 0.000000 O\n0.951789 0.451789 0.500000 O\n0.548211 0.048211 0.500000 O\n",
            "nsites": 6,
            "nelements": 2,
            "elements": [
                "Zr",
                "O"
            ],
            "chemical_system": "O-Zr",
            "density": 4.5970822436696395,
            "density_atomic": 0.06740053715605135,
            "volume": 89.02006205244773,
            "volume_molar": 8.93485573572958,
            "formula_full": "Zr2 O4",
            "formula_reduced": "ZrO2",
            "formula_anonymous": "AB2",
            "energy": -59.67959821999999,
            "energy_per_atom": -9.946599703333332,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -56.93159822,
            "band_gap": 3.4821000000000004,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 6e-07,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:35:13.230000Z",
            "spacegroup": 141
        },
        {
            "id": "mp-2574",
            "created_at": "2022-09-04T14:40:23.226164Z",
            "structure_string": "Zr2 O4\n1.0\n3.643811 0.000000 0.000000\n0.000000 3.643811 0.000000\n0.000000 0.000000 5.314560\nZr O\n2 4\ndirect\n0.000000 0.000000 0.000000 Zr\n0.500000 0.500000 0.500000 Zr\n0.500000 0.000000 0.193955 O\n0.000000 0.500000 0.306045 O\n0.000000 0.500000 0.806045 O\n0.500000 0.000000 0.693955 O\n",
            "nsites": 6,
            "nelements": 2,
            "elements": [
                "Zr",
                "O"
            ],
            "chemical_system": "O-Zr",
            "density": 5.799508196799776,
            "density_atomic": 0.08503001403629407,
            "volume": 70.56331894099148,
            "volume_molar": 7.082370652590413,
            "formula_full": "Zr2 O4",
            "formula_reduced": "ZrO2",
            "formula_anonymous": "AB2",
            "energy": -59.55148487,
            "energy_per_atom": -9.925247478333334,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -56.80348486999999,
            "band_gap": 3.8514,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:34:55.327000Z",
            "spacegroup": 137
        },
        {
            "id": "mp-775909",
            "created_at": "2022-09-04T14:46:13.791225Z",
            "structure_string": "Zr2 O4\n1.0\n4.934397 0.000000 0.000000\n0.000000 4.934397 0.000000\n0.000000 0.000000 3.283376\nZr O\n2 4\ndirect\n0.000000 0.000000 0.500000 Zr\n0.500000 0.500000 0.000000 Zr\n0.305412 0.694588 0.500000 O\n0.194588 0.194588 0.000000 O\n0.805412 0.805412 0.000000 O\n0.694588 0.305412 0.500000 O\n",
            "nsites": 6,
            "nelements": 2,
            "elements": [
                "Zr",
                "O"
            ],
            "chemical_system": "O-Zr",
            "density": 5.118955696624514,
            "density_atomic": 0.07505203199390824,
            "volume": 79.9445376840297,
            "volume_molar": 8.023954315439187,
            "formula_full": "Zr2 O4",
            "formula_reduced": "ZrO2",
            "formula_anonymous": "AB2",
            "energy": -59.4662836,
            "energy_per_atom": -9.911047266666666,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -56.71828360000001,
            "band_gap": 3.1299,
            "is_gap_direct": true,
            "is_magnetic": false,
            "total_magnetization": 2e-07,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:37:28.042000Z",
            "spacegroup": 136
        },
        {
            "id": "mp-1215343",
            "created_at": "2022-09-04T14:45:36.426085Z",
            "structure_string": "Zr2 O4 F10\n1.0\n-3.477538 -4.772242 0.000000\n-3.414596 4.715991 0.000000\n0.000000 0.000000 -7.156538\nZr O F\n2 4 10\ndirect\n0.194403 0.807255 0.000000 Zr\n0.805597 0.192745 0.000000 Zr\n0.500000 0.500000 0.582549 O\n0.500000 0.500000 0.417451 O\n0.019731 0.906782 0.500000 O\n0.980269 0.093218 0.500000 O\n0.252369 0.741651 0.720370 F\n0.747631 0.258349 0.720370 F\n0.747631 0.258349 0.279630 F\n0.252369 0.741651 0.279630 F\n0.000000 0.000000 0.836152 F\n0.000000 0.000000 0.163848 F\n0.834512 0.570415 0.000000 F\n0.165488 0.429585 0.000000 F\n0.565383 0.829122 0.000000 F\n0.434617 0.170878 0.000000 F\n",
            "nsites": 16,
            "nelements": 3,
            "elements": [
                "Zr",
                "O",
                "F"
            ],
            "chemical_system": "F-O-Zr",
            "density": 3.097239589657925,
            "density_atomic": 0.06838037168955714,
            "volume": 233.98527391221353,
            "volume_molar": 8.80682659541566,
            "formula_full": "Zr2 O4 F10",
            "formula_reduced": "ZrO2F5",
            "formula_anonymous": "AB2C5",
            "energy": -97.30776285,
            "energy_per_atom": -6.081735178125,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -92.04376285,
            "band_gap": 0.2921999999999998,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 2.002639,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:37:13.365000Z",
            "spacegroup": 10
        },
        {
            "id": "mp-1097315",
            "created_at": "2022-09-04T14:41:34.982841Z",
            "structure_string": "Zr2 Os1 Pd1\n1.0\n-4.873959 5.663280 7.888649\n4.873959 -5.663280 7.888649\n4.873959 5.663280 -7.888649\nZr Os Pd\n2 1 1\ndirect\n0.000000 0.262050 0.262050 Zr\n0.000000 0.737950 0.737950 Zr\n0.000000 0.500000 0.500000 Os\n0.000000 0.000000 0.000000 Pd\n",
            "nsites": 4,
            "nelements": 3,
            "elements": [
                "Zr",
                "Os",
                "Pd"
            ],
            "chemical_system": "Os-Pd-Zr",
            "density": 0.9133998277518555,
            "density_atomic": 0.004592481984714881,
            "volume": 870.9887188045955,
            "volume_molar": 131.1304166253333,
            "formula_full": "Zr2 Os1 Pd1",
            "formula_reduced": "Zr2OsPd",
            "formula_anonymous": "ABC2",
            "energy": -21.62925333,
            "energy_per_atom": -5.4073133325,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -21.62925333,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 1.9998336,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:35:28.760000Z",
            "spacegroup": 71
        },
        {
            "id": "mp-1097342",
            "created_at": "2022-09-04T14:45:23.487952Z",
            "structure_string": "Zr2 Os1 Rh1\n1.0\n-4.660358 5.576981 7.867393\n4.660358 -5.576981 7.867393\n4.660358 5.576981 -7.867393\nZr Os Rh\n2 1 1\ndirect\n0.000000 0.252241 0.252241 Zr\n0.000000 0.747759 0.747759 Zr\n0.000000 0.500000 0.500000 Os\n0.000000 0.000000 0.000000 Rh\n",
            "nsites": 4,
            "nelements": 3,
            "elements": [
                "Zr",
                "Os",
                "Rh"
            ],
            "chemical_system": "Os-Rh-Zr",
            "density": 0.9655318295588736,
            "density_atomic": 0.004890471252996167,
            "volume": 817.9170867325688,
            "volume_molar": 123.14029565781644,
            "formula_full": "Zr2 Os1 Rh1",
            "formula_reduced": "Zr2OsRh",
            "formula_anonymous": "ABC2",
            "energy": -23.51470528,
            "energy_per_atom": -5.87867632,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -23.51470528,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.000132,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:37:09.777000Z",
            "spacegroup": 71
        }
    ]
}