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=nelements&page=10",
"previous": "https://simmate.org/third-parties/AflowPrototype/?format=api&ordering=nelements&page=8",
"results": [
{
"id": 154,
"created_at": "2022-09-04T14:35:36.598386Z",
"updated_at": "2022-09-04T14:35:36.598408Z",
"structure_string": "Cr6 Cl18\n1.0\n-3.008500 -5.210875 -0.000000\n-3.008500 5.210875 0.000000\n0.000000 0.000000 -17.300000\nCr Cl\n6 18\ndirect\n0.111100 0.222200 0.666670 Cr\n0.111100 0.888900 0.333337 Cr\n0.777800 0.888900 0.000003 Cr\n0.444400 0.888800 0.666670 Cr\n0.444400 0.555600 0.333337 Cr\n0.111200 0.555600 0.000003 Cr\n0.111100 0.222200 0.926900 Cl\n0.111100 0.888900 0.593567 Cl\n0.777800 0.888900 0.260233 Cl\n0.111100 0.888900 0.073100 Cl\n0.777800 0.888900 0.739767 Cl\n0.111100 0.222200 0.406433 Cl\n0.444400 0.888800 0.926900 Cl\n0.444400 0.555600 0.593567 Cl\n0.111200 0.555600 0.260233 Cl\n0.444400 0.555600 0.073100 Cl\n0.111200 0.555600 0.739767 Cl\n0.444400 0.888800 0.406433 Cl\n0.777800 0.555580 0.926900 Cl\n0.777780 0.222200 0.593567 Cl\n0.444420 0.222220 0.260233 Cl\n0.777800 0.222220 0.073100 Cl\n0.444420 0.222200 0.739767 Cl\n0.777780 0.555580 0.406433 Cl\n",
"nsites": 24,
"nelements": 2,
"elements": [
"Cr",
"Cl"
],
"chemical_system": "Cl-Cr",
"density": 2.9086779107259777,
"density_atomic": 0.044246046537049624,
"volume": 542.4213433375,
"volume_molar": 13.610573670027973,
"formula_full": "Cr6 Cl18",
"formula_reduced": "CrCl3",
"formula_anonymous": "AB3",
"mineral_name": "Chromium trichloride",
"aflow_id": "A3B_hP24_151_3c_2a",
"pearson_symbol": "hP24",
"strukturbericht_symbol": "D0_4",
"nsites_wyckoff": 5,
"spacegroup": 151
},
{
"id": 44,
"created_at": "2022-09-04T14:35:36.580544Z",
"updated_at": "2022-09-04T14:35:36.580572Z",
"structure_string": "Hg4 Cl8\n1.0\n0.000000 0.000000 -4.325000\n0.000000 -5.963000 -0.000000\n-12.735000 0.000000 -0.000000\nHg Cl\n4 8\ndirect\n0.553000 0.750000 0.126000 Hg\n0.947000 0.750000 0.626000 Hg\n0.447000 0.250000 0.874000 Hg\n0.053000 0.250000 0.374000 Hg\n0.875000 0.750000 0.267000 Cl\n0.625000 0.750000 0.767000 Cl\n0.125000 0.250000 0.733000 Cl\n0.375000 0.250000 0.233000 Cl\n0.278000 0.750000 0.492000 Cl\n0.222000 0.750000 0.992000 Cl\n0.722000 0.250000 0.508000 Cl\n0.778000 0.250000 0.008000 Cl\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Hg",
"Cl"
],
"chemical_system": "Cl-Hg",
"density": 5.490636006730003,
"density_atomic": 0.03653687299910025,
"volume": 328.435331625,
"volume_molar": 16.48236498002525,
"formula_full": "Hg4 Cl8",
"formula_reduced": "HgCl2",
"formula_anonymous": "AB2",
"mineral_name": null,
"aflow_id": "A2B_oP12_62_2c_c",
"pearson_symbol": "oP12",
"strukturbericht_symbol": "C25",
"nsites_wyckoff": 3,
"spacegroup": 62
},
{
"id": 14,
"created_at": "2022-09-04T14:35:36.680219Z",
"updated_at": "2022-09-04T14:35:36.680234Z",
"structure_string": "Ca2 Cl4\n1.0\n-0.000000 -0.000000 4.200000\n6.240000 -0.000000 0.000000\n-0.000000 6.430000 0.000000\nCa Cl\n2 4\ndirect\n0.000000 0.000000 0.000000 Ca\n0.500000 0.500000 0.500000 Ca\n0.000000 0.275000 0.325000 Cl\n0.500000 0.775000 0.175000 Cl\n0.500000 0.225000 0.825000 Cl\n0.000000 0.725000 0.675000 Cl\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Ca",
"Cl"
],
"chemical_system": "Ca-Cl",
"density": 2.187230802551171,
"density_atomic": 0.03560462347398584,
"volume": 168.51744,
"volume_molar": 16.913929069914243,
"formula_full": "Ca2 Cl4",
"formula_reduced": "CaCl2",
"formula_anonymous": "AB2",
"mineral_name": "Hydrophilite",
"aflow_id": "AB2_oP6_58_a_g",
"pearson_symbol": "oP6",
"strukturbericht_symbol": "C35",
"nsites_wyckoff": 2,
"spacegroup": 58
},
{
"id": 193,
"created_at": "2022-09-04T14:35:36.679103Z",
"updated_at": "2022-09-04T14:35:36.679125Z",
"structure_string": "Fe12 C4\n1.0\n-0.000000 -0.000000 4.523000\n5.090000 -0.000000 0.000000\n-0.000000 6.748000 0.000000\nFe C\n12 4\ndirect\n0.852000 0.036000 0.250000 Fe\n0.648000 0.536000 0.250000 Fe\n0.148000 0.964000 0.750000 Fe\n0.352000 0.464000 0.750000 Fe\n0.328000 0.186000 0.063000 Fe\n0.172000 0.686000 0.437000 Fe\n0.672000 0.814000 0.563000 Fe\n0.828000 0.314000 0.937000 Fe\n0.672000 0.814000 0.937000 Fe\n0.828000 0.314000 0.563000 Fe\n0.328000 0.186000 0.437000 Fe\n0.172000 0.686000 0.063000 Fe\n0.050000 0.390000 0.250000 C\n0.450000 0.890000 0.250000 C\n0.950000 0.610000 0.750000 C\n0.550000 0.110000 0.750000 C\n",
"nsites": 16,
"nelements": 2,
"elements": [
"Fe",
"C"
],
"chemical_system": "C-Fe",
"density": 7.676524729528275,
"density_atomic": 0.10299129967426898,
"volume": 155.35292836,
"volume_molar": 5.847232512888224,
"formula_full": "Fe12 C4",
"formula_reduced": "Fe3C",
"formula_anonymous": "AB3",
"mineral_name": "Cementite",
"aflow_id": "AB3_oP16_62_c_cd",
"pearson_symbol": "oP16",
"strukturbericht_symbol": "D0_11",
"nsites_wyckoff": 3,
"spacegroup": 62
},
{
"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": 190,
"created_at": "2022-09-04T14:35:36.619613Z",
"updated_at": "2022-09-04T14:35:36.619637Z",
"structure_string": "Pu8 C12\n1.0\n-4.067500 -4.067500 4.067500\n-4.067500 4.067500 -4.067500\n4.067500 -4.067500 -4.067500\nC Pu\n12 8\ndirect\n0.710400 0.460400 0.750000 C\n0.789600 0.039600 0.250000 C\n0.750000 0.710400 0.460400 C\n0.250000 0.789600 0.039600 C\n0.460400 0.750000 0.710400 C\n0.039600 0.250000 0.789600 C\n0.210400 0.250000 0.960400 C\n0.289600 0.750000 0.539600 C\n0.960400 0.210400 0.250000 C\n0.539600 0.289600 0.750000 C\n0.250000 0.960400 0.210400 C\n0.750000 0.539600 0.289600 C\n0.901600 0.901600 0.901600 Pu\n0.000000 0.500000 0.598400 Pu\n0.500000 0.598400 0.000000 Pu\n0.598400 1.000000 0.500000 Pu\n0.401600 0.401600 0.401600 Pu\n1.000000 0.500000 0.098400 Pu\n0.500000 0.098400 0.000000 Pu\n0.098400 1.000000 0.500000 Pu\n",
"nsites": 20,
"nelements": 2,
"elements": [
"C",
"Pu"
],
"chemical_system": "C-Pu",
"density": 12.930767514447428,
"density_atomic": 0.07429974436083998,
"volume": 269.17993018749996,
"volume_molar": 8.10519714678049,
"formula_full": "Pu8 C12",
"formula_reduced": "Pu2C3",
"formula_anonymous": "A2B3",
"mineral_name": "Plutonium carbide",
"aflow_id": "A3B2_cI40_220_d_c",
"pearson_symbol": "cI40",
"strukturbericht_symbol": "D5_c",
"nsites_wyckoff": 2,
"spacegroup": 220
},
{
"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": 18,
"created_at": "2022-09-04T14:35:36.758555Z",
"updated_at": "2022-09-04T14:35:36.758570Z",
"structure_string": "Mo6 C6\n1.0\n-1.505000 -2.606736 -0.000000\n-1.505000 2.606736 0.000000\n0.000000 0.000000 -14.610000\nMo C\n6 6\ndirect\n0.000000 0.000000 0.750000 Mo\n0.000000 0.000000 0.250000 Mo\n0.666670 0.333340 0.417000 Mo\n0.333340 0.666670 0.917000 Mo\n0.333340 0.666670 0.583000 Mo\n0.666670 0.333330 0.083000 Mo\n0.000000 0.000000 0.000000 C\n0.000000 0.000000 0.500000 C\n0.666670 0.333340 0.834000 C\n0.333340 0.666670 0.334000 C\n0.333340 0.666670 0.166000 C\n0.666670 0.333330 0.666000 C\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Mo",
"C"
],
"chemical_system": "C-Mo",
"density": 9.38235906341074,
"density_atomic": 0.10468090889683362,
"volume": 114.63408300959999,
"volume_molar": 5.7528548648111295,
"formula_full": "Mo6 C6",
"formula_reduced": "MoC",
"formula_anonymous": "AB",
"mineral_name": "Molybdenum Carbide MAX Phase",
"aflow_id": "AB_hP12_194_af_bf",
"pearson_symbol": "hP12",
"strukturbericht_symbol": "None",
"nsites_wyckoff": 4,
"spacegroup": 194
},
{
"id": 81,
"created_at": "2022-09-04T14:35:36.640518Z",
"updated_at": "2022-09-04T14:35:36.640541Z",
"structure_string": "Cu1 Pt1\n1.0\n-1.565000 -2.710660 -0.000000\n1.565000 -2.710660 -0.000000\n-0.000000 -1.807106 4.993333\nCu Pt\n1 1\ndirect\n0.000000 0.000000 0.000000 Cu\n0.500000 0.500000 0.500000 Pt\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Cu",
"Pt"
],
"chemical_system": "Cu-Pt",
"density": 10.137201588056852,
"density_atomic": 0.047208486948049855,
"volume": 42.36526373321139,
"volume_molar": 12.756479076796104,
"formula_full": "Cu1 Pt1",
"formula_reduced": "CuPt",
"formula_anonymous": "AB",
"mineral_name": null,
"aflow_id": "AB_hR2_166_a_b",
"pearson_symbol": "hR2",
"strukturbericht_symbol": "L1_1",
"nsites_wyckoff": 2,
"spacegroup": 166
},
{
"id": 230,
"created_at": "2022-09-04T14:35:36.684684Z",
"updated_at": "2022-09-04T14:35:36.684707Z",
"structure_string": "V2 Au4\n1.0\n-4.684000 0.000000 -0.000000\n0.000000 0.000000 -4.810000\n0.000000 -4.241000 2.405000\nAu V\n4 2\ndirect\n1.000000 0.270000 0.660000 Au\n1.000000 0.610000 0.340000 Au\n0.500000 0.830000 0.660000 Au\n0.500000 0.170000 0.340000 Au\n0.000000 0.940000 0.000000 V\n0.500000 0.500000 0.000000 V\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Au",
"V"
],
"chemical_system": "Au-V",
"density": 15.462741853666543,
"density_atomic": 0.06279441446412806,
"volume": 95.54989963999999,
"volume_molar": 9.590249087265889,
"formula_full": "V2 Au4",
"formula_reduced": "VAu2",
"formula_anonymous": "AB2",
"mineral_name": null,
"aflow_id": "A2B_oC12_38_de_ab",
"pearson_symbol": "oC12",
"strukturbericht_symbol": "None",
"nsites_wyckoff": 2,
"spacegroup": 63
},
{
"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
},
{
"id": 11,
"created_at": "2022-09-04T14:35:36.637501Z",
"updated_at": "2022-09-04T14:35:36.637521Z",
"structure_string": "Fe2 S4\n1.0\n-0.000000 -0.000000 3.386400\n4.444600 -0.000000 0.000000\n-0.000000 5.424600 0.000000\nFe S\n2 4\ndirect\n0.000000 0.000000 0.000000 Fe\n0.500000 0.500000 0.500000 Fe\n0.000000 0.200400 0.378700 S\n0.500000 0.700400 0.121300 S\n0.500000 0.299600 0.878700 S\n0.000000 0.799600 0.621300 S\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Fe",
"S"
],
"chemical_system": "Fe-S",
"density": 4.880127792417843,
"density_atomic": 0.07348735112202824,
"volume": 81.64670393462401,
"volume_molar": 8.19479906140586,
"formula_full": "Fe2 S4",
"formula_reduced": "FeS2",
"formula_anonymous": "AB2",
"mineral_name": "Marcasite",
"aflow_id": "AB2_oP6_58_a_g",
"pearson_symbol": "oP6",
"strukturbericht_symbol": "C18",
"nsites_wyckoff": 2,
"spacegroup": 58
}
]
}