Aflow Prototype

HTTP 200 OK
Allow: GET, HEAD, OPTIONS
Content-Type: application/json
Vary: Accept

{
    "count": 288,
    "next": "https://simmate.org/third-parties/AflowPrototype/?format=api&ordering=id&page=20",
    "previous": "https://simmate.org/third-parties/AflowPrototype/?format=api&ordering=id&page=18",
    "results": [
        {
            "id": 217,
            "created_at": "2022-09-04T14:35:36.456931Z",
            "updated_at": "2022-09-04T14:35:36.456950Z",
            "structure_string": "Ni4 Sb4 S4\n1.0\n5.881000 0.000000 0.000000\n-0.000000 5.881000 0.000000\n0.000000 0.000000 5.881000\nNi Sb S\n4 4 4\ndirect\n0.976000 0.976000 0.976000 Ni\n0.476000 0.524000 0.024000 Ni\n0.024000 0.476000 0.524000 Ni\n0.524000 0.024000 0.476000 Ni\n0.875000 0.875000 0.875000 Sb\n0.375000 0.625000 0.125000 Sb\n0.125000 0.375000 0.625000 Sb\n0.625000 0.125000 0.375000 Sb\n0.390000 0.390000 0.390000 S\n0.890000 0.110000 0.610000 S\n0.610000 0.890000 0.110000 S\n0.110000 0.610000 0.890000 S\n",
            "nsites": 12,
            "nelements": 3,
            "elements": [
                "Ni",
                "Sb",
                "S"
            ],
            "chemical_system": "Ni-S-Sb",
            "density": 6.939882032014934,
            "density_atomic": 0.058996698359810036,
            "volume": 203.40121284100005,
            "volume_molar": 10.20758945402685,
            "formula_full": "Ni4 Sb4 S4",
            "formula_reduced": "NiSbS",
            "formula_anonymous": "ABC",
            "mineral_name": "Ullmanite",
            "aflow_id": "ABC_cP12_198_a_a_a",
            "pearson_symbol": "cP12",
            "strukturbericht_symbol": "F0_1",
            "nsites_wyckoff": 3,
            "spacegroup": 198
        },
        {
            "id": 218,
            "created_at": "2022-09-04T14:35:36.471433Z",
            "updated_at": "2022-09-04T14:35:36.471455Z",
            "structure_string": "Si46\n1.0\n10.355000 0.000000 0.000000\n-0.000000 10.355000 0.000000\n0.000000 0.000000 10.355000\nSi\n46\ndirect\n0.250000 0.500000 0.000000 Si\n0.750000 0.500000 0.000000 Si\n0.500000 0.000000 0.250000 Si\n0.500000 0.000000 0.750000 Si\n0.000000 0.250000 0.500000 Si\n0.000000 0.750000 0.500000 Si\n0.183700 0.183700 0.183700 Si\n0.183700 0.816300 0.816300 Si\n0.816300 0.183700 0.816300 Si\n0.816300 0.816300 0.183700 Si\n0.316300 0.316300 0.316300 Si\n0.316300 0.683700 0.683700 Si\n0.683700 0.316300 0.683700 Si\n0.683700 0.683700 0.316300 Si\n0.816300 0.816300 0.816300 Si\n0.816300 0.183700 0.183700 Si\n0.183700 0.816300 0.183700 Si\n0.183700 0.183700 0.816300 Si\n0.683700 0.683700 0.683700 Si\n0.683700 0.316300 0.316300 Si\n0.316300 0.683700 0.316300 Si\n0.316300 0.316300 0.683700 Si\n0.000000 0.117200 0.307700 Si\n0.000000 0.882800 0.692300 Si\n0.000000 0.117200 0.692300 Si\n0.000000 0.882800 0.307700 Si\n0.117200 0.307700 0.000000 Si\n0.117200 0.692300 0.000000 Si\n0.882800 0.307700 0.000000 Si\n0.882800 0.692300 0.000000 Si\n0.307700 0.000000 0.117200 Si\n0.307700 0.000000 0.882800 Si\n0.692300 0.000000 0.882800 Si\n0.692300 0.000000 0.117200 Si\n0.382800 0.500000 0.192300 Si\n0.382800 0.500000 0.807700 Si\n0.617200 0.500000 0.807700 Si\n0.617200 0.500000 0.192300 Si\n0.500000 0.192300 0.382800 Si\n0.500000 0.807700 0.617200 Si\n0.500000 0.192300 0.617200 Si\n0.500000 0.807700 0.382800 Si\n0.192300 0.382800 0.500000 Si\n0.192300 0.617200 0.500000 Si\n0.807700 0.382800 0.500000 Si\n0.807700 0.617200 0.500000 Si\n",
            "nsites": 46,
            "nelements": 1,
            "elements": [
                "Si"
            ],
            "chemical_system": "Si",
            "density": 1.9321408356601775,
            "density_atomic": 0.041429292996423915,
            "volume": 1110.325488875,
            "volume_molar": 14.535948659611012,
            "formula_full": "Si46",
            "formula_reduced": "Si",
            "formula_anonymous": "A",
            "mineral_name": "Clathrate",
            "aflow_id": "A_cP46_223_dik",
            "pearson_symbol": "cP46",
            "strukturbericht_symbol": "None",
            "nsites_wyckoff": 3,
            "spacegroup": 223
        },
        {
            "id": 219,
            "created_at": "2022-09-04T14:35:36.477276Z",
            "updated_at": "2022-09-04T14:35:36.477291Z",
            "structure_string": "Si24 O48\n1.0\n0.000000 -5.003200 -0.000000\n8.911182 -2.501600 -2.524970\n8.911182 -2.501600 21.285030\nO Si\n48 24\ndirect\n0.074100 0.331600 0.818200 O\n0.776100 0.831600 0.318200 O\n0.589300 0.293800 0.847600 O\n0.269300 0.793800 0.347600 O\n0.130500 0.977900 0.485100 O\n0.406500 0.477900 0.985100 O\n0.605100 0.986600 0.515200 O\n0.893100 0.486600 0.015200 O\n0.232500 0.156900 0.674100 O\n0.936500 0.656900 0.174100 O\n0.735300 0.182000 0.643400 O\n0.439300 0.682000 0.143400 O\n0.958700 0.833300 0.921300 O\n0.286700 0.333300 0.421300 O\n0.416000 0.895900 0.936100 O\n0.752000 0.395900 0.436100 O\n0.080900 0.794400 0.753800 O\n0.370900 0.294400 0.253800 O\n0.623400 0.727000 0.740200 O\n0.909400 0.227000 0.240200 O\n0.039500 0.654300 0.584700 O\n0.721500 0.154300 0.084700 O\n0.575900 0.596100 0.566100 O\n0.261900 0.096100 0.066100 O\n0.992400 0.387000 0.606200 O\n0.014400 0.887000 0.106200 O\n0.157700 0.140100 0.566500 O\n0.135700 0.640100 0.066500 O\n0.345200 0.628500 0.671100 O\n0.355200 0.128500 0.171100 O\n0.351600 0.524300 0.780500 O\n0.343600 0.024300 0.280500 O\n0.637400 0.994400 0.732800 O\n0.635400 0.494400 0.232800 O\n0.660900 0.838900 0.833300 O\n0.666900 0.338900 0.333300 O\n0.501800 0.270600 0.739800 O\n0.487800 0.770600 0.239800 O\n0.852100 0.347000 0.926800 O\n0.874100 0.847000 0.426800 O\n0.015300 0.098600 0.886800 O\n0.999300 0.598600 0.386800 O\n0.032000 0.500000 0.500000 O\n0.968000 0.000000 1.000000 O\n0.283800 0.860600 0.589800 O\n0.265800 0.360600 0.089800 O\n0.704600 0.633300 0.915500 O\n0.746600 0.133300 0.415500 O\n0.908300 0.537200 0.564200 Si\n0.990300 0.037200 0.064200 Si\n0.349400 0.672500 0.734700 Si\n0.243400 0.172500 0.234700 Si\n0.031200 0.217100 0.622500 Si\n0.129200 0.717100 0.122500 Si\n0.381900 0.354700 0.795500 Si\n0.467900 0.854700 0.295500 Si\n0.527300 0.152300 0.697100 Si\n0.623300 0.652300 0.197100 Si\n0.291700 0.990000 0.538600 Si\n0.179700 0.490000 0.038600 Si\n0.748700 0.838500 0.766100 Si\n0.646700 0.338500 0.266100 Si\n0.313700 0.687900 0.602700 Si\n0.395700 0.187900 0.102700 Si\n0.683900 0.804600 0.901600 Si\n0.609900 0.304600 0.401600 Si\n0.084700 0.962800 0.935800 Si\n0.016700 0.462800 0.435800 Si\n0.716600 0.488300 0.960500 Si\n0.834600 0.988300 0.460500 Si\n0.881300 0.269200 0.870200 Si\n0.979300 0.769200 0.370200 Si\n",
            "nsites": 72,
            "nelements": 2,
            "elements": [
                "O",
                "Si"
            ],
            "chemical_system": "O-Si",
            "density": 2.255686664661165,
            "density_atomic": 0.06782501889714358,
            "volume": 1061.555177878944,
            "volume_molar": 8.878937091241443,
            "formula_full": "Si24 O48",
            "formula_reduced": "SiO2",
            "formula_anonymous": "AB2",
            "mineral_name": "Low Tridymite",
            "aflow_id": "A2B_mC144_9_24a_12a",
            "pearson_symbol": "mC144",
            "strukturbericht_symbol": "None",
            "nsites_wyckoff": 36,
            "spacegroup": 9
        },
        {
            "id": 220,
            "created_at": "2022-09-04T14:35:36.462138Z",
            "updated_at": "2022-09-04T14:35:36.462163Z",
            "structure_string": "Bi2 Te3\n1.0\n-2.184570 -3.783786 -0.000000\n2.184570 -3.783786 -0.000000\n-0.000000 -2.522524 10.140977\nBi Te\n2 3\ndirect\n0.601000 0.601000 0.197000 Bi\n0.399000 0.399000 0.803000 Bi\n0.000000 0.000000 0.000000 Te\n0.792000 0.792000 0.624000 Te\n0.208000 0.208000 0.376000 Te\n",
            "nsites": 5,
            "nelements": 2,
            "elements": [
                "Bi",
                "Te"
            ],
            "chemical_system": "Bi-Te",
            "density": 7.931394969931746,
            "density_atomic": 0.029824122852037175,
            "volume": 167.64952400464205,
            "volume_molar": 20.192180638059064,
            "formula_full": "Bi2 Te3",
            "formula_reduced": "Bi2Te3",
            "formula_anonymous": "A2B3",
            "mineral_name": null,
            "aflow_id": "A2B3_hR5_166_c_ac",
            "pearson_symbol": "hR5",
            "strukturbericht_symbol": "C33",
            "nsites_wyckoff": 3,
            "spacegroup": 166
        },
        {
            "id": 221,
            "created_at": "2022-09-04T14:35:36.524858Z",
            "updated_at": "2022-09-04T14:35:36.524880Z",
            "structure_string": "Ti1 Pt8\n1.0\n0.000000 0.000000 3.897000\n-4.156000 4.156000 1.948500\n-4.156000 -4.156000 1.948500\nPt Ti\n8 1\ndirect\n0.333000 0.000000 0.334000 Pt\n0.333000 0.334000 1.000000 Pt\n0.667000 0.666000 1.000000 Pt\n0.667000 1.000000 0.666000 Pt\n0.327000 0.673000 0.673000 Pt\n0.673000 0.327000 0.327000 Pt\n0.000000 0.673000 0.327000 Pt\n0.000000 0.327000 0.673000 Pt\n0.000000 0.000000 0.000000 Ti\n",
            "nsites": 9,
            "nelements": 2,
            "elements": [
                "Pt",
                "Ti"
            ],
            "chemical_system": "Pt-Ti",
            "density": 19.841258409721608,
            "density_atomic": 0.06685455928401639,
            "volume": 134.62058678399998,
            "volume_molar": 9.007823586744928,
            "formula_full": "Ti1 Pt8",
            "formula_reduced": "TiPt8",
            "formula_anonymous": "AB8",
            "mineral_name": null,
            "aflow_id": "A8B_tI18_139_hi_a",
            "pearson_symbol": "tI18",
            "strukturbericht_symbol": "None",
            "nsites_wyckoff": 3,
            "spacegroup": 139
        },
        {
            "id": 222,
            "created_at": "2022-09-04T14:35:36.537521Z",
            "updated_at": "2022-09-04T14:35:36.537549Z",
            "structure_string": "Pt2 S2\n1.0\n4.907300 0.000000 0.000000\n-0.000000 4.907300 0.000000\n0.000000 0.000000 6.109600\nPt S\n2 2\ndirect\n0.000000 0.500000 0.000000 Pt\n0.500000 0.000000 0.500000 Pt\n0.000000 0.000000 0.250000 S\n0.000000 0.000000 0.750000 S\n",
            "nsites": 4,
            "nelements": 2,
            "elements": [
                "Pt",
                "S"
            ],
            "chemical_system": "Pt-S",
            "density": 5.127337761338703,
            "density_atomic": 0.027187044392460964,
            "volume": 147.128902364584,
            "volume_molar": 22.150773997595543,
            "formula_full": "Pt2 S2",
            "formula_reduced": "PtS",
            "formula_anonymous": "AB",
            "mineral_name": null,
            "aflow_id": "AB_tP4_131_c_e",
            "pearson_symbol": "tP4",
            "strukturbericht_symbol": "B17",
            "nsites_wyckoff": 2,
            "spacegroup": 131
        },
        {
            "id": 223,
            "created_at": "2022-09-04T14:35:36.566431Z",
            "updated_at": "2022-09-04T14:35:36.566456Z",
            "structure_string": "Mn4 P4\n1.0\n0.000000 -3.180200 -0.000000\n-5.241600 0.000000 -0.000000\n0.000000 0.000000 -5.903200\nMn P\n4 4\ndirect\n0.750000 0.994400 0.804800 Mn\n0.750000 0.494400 0.695200 Mn\n0.250000 0.005600 0.195200 Mn\n0.250000 0.505600 0.304800 Mn\n0.750000 0.812100 0.430400 P\n0.750000 0.312100 0.069600 P\n0.250000 0.187900 0.569600 P\n0.250000 0.687900 0.930400 P\n",
            "nsites": 8,
            "nelements": 2,
            "elements": [
                "Mn",
                "P"
            ],
            "chemical_system": "Mn-P",
            "density": 5.799040424780339,
            "density_atomic": 0.08129880849328638,
            "volume": 98.402426164224,
            "volume_molar": 7.4074157685807975,
            "formula_full": "Mn4 P4",
            "formula_reduced": "MnP",
            "formula_anonymous": "AB",
            "mineral_name": null,
            "aflow_id": "AB_oP8_62_c_c",
            "pearson_symbol": "oP8",
            "strukturbericht_symbol": "B31",
            "nsites_wyckoff": 2,
            "spacegroup": 62
        },
        {
            "id": 224,
            "created_at": "2022-09-04T14:35:36.564391Z",
            "updated_at": "2022-09-04T14:35:36.564405Z",
            "structure_string": "B1 P1 O4\n1.0\n-4.340400 0.000000 0.000000\n-0.000000 4.340400 0.000000\n2.170200 -2.170200 -3.325100\nB O P\n1 4 1\ndirect\n0.750000 0.250000 0.500000 B\n0.371800 0.884400 0.255600 O\n0.883800 0.371200 0.255600 O\n0.115600 0.116200 0.744400 O\n0.628800 0.628200 0.744400 O\n0.000000 0.000000 0.000000 P\n",
            "nsites": 6,
            "nelements": 3,
            "elements": [
                "B",
                "O",
                "P"
            ],
            "chemical_system": "B-O-P",
            "density": 2.804129956565944,
            "density_atomic": 0.0957826900118294,
            "volume": 62.64179883921599,
            "volume_molar": 6.287295501156055,
            "formula_full": "B1 P1 O4",
            "formula_reduced": "BPO4",
            "formula_anonymous": "ABC4",
            "mineral_name": null,
            "aflow_id": "AB4C_tI12_82_c_g_a",
            "pearson_symbol": "tI12",
            "strukturbericht_symbol": "H0_7",
            "nsites_wyckoff": 3,
            "spacegroup": 82
        },
        {
            "id": 225,
            "created_at": "2022-09-04T14:35:36.593508Z",
            "updated_at": "2022-09-04T14:35:36.593542Z",
            "structure_string": "Li3 N1\n1.0\n-1.828800 -3.167575 -0.000000\n-1.828800 3.167575 0.000000\n0.000000 0.000000 -3.873500\nLi N\n3 1\ndirect\n0.000000 0.000000 0.500000 Li\n0.666670 0.333340 1.000000 Li\n0.333340 0.666670 0.000000 Li\n0.000000 0.000000 0.000000 N\n",
            "nsites": 4,
            "nelements": 2,
            "elements": [
                "Li",
                "N"
            ],
            "chemical_system": "Li-N",
            "density": 1.2887603186433403,
            "density_atomic": 0.08913193105257543,
            "volume": 44.87729540651999,
            "volume_molar": 6.75643474665412,
            "formula_full": "Li3 N1",
            "formula_reduced": "Li3N",
            "formula_anonymous": "AB3",
            "mineral_name": null,
            "aflow_id": "A3B_hP4_191_bc_a",
            "pearson_symbol": "hP4",
            "strukturbericht_symbol": "None",
            "nsites_wyckoff": 3,
            "spacegroup": 191
        },
        {
            "id": 226,
            "created_at": "2022-09-04T14:35:36.614604Z",
            "updated_at": "2022-09-04T14:35:36.614617Z",
            "structure_string": "Ni2 As2\n1.0\n-1.809500 -3.134146 -0.000000\n-1.809500 3.134146 0.000000\n0.000000 0.000000 -5.044000\nNi As\n2 2\ndirect\n0.000000 0.000000 0.000000 Ni\n0.000000 0.000000 0.500000 Ni\n0.666670 0.333340 0.750000 As\n0.333340 0.666670 0.250000 As\n",
            "nsites": 4,
            "nelements": 2,
            "elements": [
                "Ni",
                "As"
            ],
            "chemical_system": "As-Ni",
            "density": 7.756243314428873,
            "density_atomic": 0.06991608580539806,
            "volume": 57.211440742456,
            "volume_molar": 8.613383730836723,
            "formula_full": "Ni2 As2",
            "formula_reduced": "NiAs",
            "formula_anonymous": "AB",
            "mineral_name": null,
            "aflow_id": "AB_hP4_194_c_a",
            "pearson_symbol": "hP4",
            "strukturbericht_symbol": "B8_1",
            "nsites_wyckoff": 2,
            "spacegroup": 194
        },
        {
            "id": 227,
            "created_at": "2022-09-04T14:35:36.636374Z",
            "updated_at": "2022-09-04T14:35:36.636388Z",
            "structure_string": "Fe4 S8\n1.0\n5.417000 0.000000 0.000000\n-0.000000 5.417000 0.000000\n0.000000 0.000000 5.417000\nFe S\n4 8\ndirect\n0.001000 0.002000 0.003000 Fe\n0.496600 0.000100 0.503600 Fe\n0.500100 0.502000 0.001100 Fe\n0.999400 0.501300 0.503800 Fe\n0.385700 0.383200 0.384000 S\n0.114900 0.611400 0.884600 S\n0.885400 0.115700 0.614300 S\n0.615300 0.886500 0.114100 S\n0.615100 0.613200 0.613700 S\n0.885400 0.381800 0.114900 S\n0.114700 0.885600 0.384100 S\n0.385700 0.116100 0.884200 S\n",
            "nsites": 12,
            "nelements": 2,
            "elements": [
                "Fe",
                "S"
            ],
            "chemical_system": "Fe-S",
            "density": 5.013295921729485,
            "density_atomic": 0.07549266194446057,
            "volume": 158.95584671299997,
            "volume_molar": 7.977120696088911,
            "formula_full": "Fe4 S8",
            "formula_reduced": "FeS2",
            "formula_anonymous": "AB2",
            "mineral_name": "pyrite",
            "aflow_id": "AB2_aP12_1_4a_8a",
            "pearson_symbol": "aP12",
            "strukturbericht_symbol": "None",
            "nsites_wyckoff": 12,
            "spacegroup": 205
        },
        {
            "id": 228,
            "created_at": "2022-09-04T14:35:36.644860Z",
            "updated_at": "2022-09-04T14:35:36.644891Z",
            "structure_string": "Cu2 Te2\n1.0\n3.150000 0.000000 0.000000\n-0.000000 4.090000 0.000000\n0.000000 0.000000 6.950000\nCu Te\n2 2\ndirect\n0.250000 0.250000 0.051000 Cu\n0.750000 0.750000 0.949000 Cu\n0.250000 0.750000 0.277000 Te\n0.750000 0.250000 0.723000 Te\n",
            "nsites": 4,
            "nelements": 2,
            "elements": [
                "Cu",
                "Te"
            ],
            "chemical_system": "Cu-Te",
            "density": 7.089663800624435,
            "density_atomic": 0.044672609798992804,
            "volume": 89.540325,
            "volume_molar": 13.480611021153674,
            "formula_full": "Cu2 Te2",
            "formula_reduced": "CuTe",
            "formula_anonymous": "AB",
            "mineral_name": "Vulcanite",
            "aflow_id": "AB_oP4_59_a_b",
            "pearson_symbol": "oP4",
            "strukturbericht_symbol": "None",
            "nsites_wyckoff": 2,
            "spacegroup": 59
        }
    ]
}