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=elements&page=21",
"previous": "https://simmate.org/third-parties/AflowPrototype/?format=api&ordering=elements&page=19",
"results": [
{
"id": 138,
"created_at": "2022-09-04T14:35:37.076424Z",
"updated_at": "2022-09-04T14:35:37.076457Z",
"structure_string": "Zn3 Ag6\n1.0\n0.000000 0.000000 -2.819700\n-3.818000 -6.612970 -0.000000\n-3.818000 6.612970 0.000000\nZn Ag\n3 6\ndirect\n0.000000 0.000000 0.000000 Zn\n0.750000 0.666670 0.333340 Zn\n0.250000 0.333330 0.666660 Zn\n0.750000 0.666670 0.666670 Ag\n0.750000 1.000000 0.333330 Ag\n0.750000 0.333330 1.000000 Ag\n0.250000 0.333330 0.333330 Ag\n0.250000 1.000000 0.666670 Ag\n0.250000 0.666670 0.000000 Ag\n",
"nsites": 9,
"nelements": 2,
"elements": [
"Zn",
"Ag"
],
"chemical_system": "Ag-Zn",
"density": 9.836394940782235,
"density_atomic": 0.06320873995250843,
"volume": 142.38537276272402,
"volume_molar": 9.5273861882466,
"formula_full": "Zn3 Ag6",
"formula_reduced": "ZnAg2",
"formula_anonymous": "AB2",
"mineral_name": "zeta silver zinc",
"aflow_id": "A2B_hP9_147_g_ad",
"pearson_symbol": "hP9",
"strukturbericht_symbol": "B_b",
"nsites_wyckoff": 3,
"spacegroup": 147
},
{
"id": 64,
"created_at": "2022-09-04T14:35:36.948308Z",
"updated_at": "2022-09-04T14:35:36.948337Z",
"structure_string": "Zn2 S2\n1.0\n-1.911350 -3.310555 -0.000000\n-1.911350 3.310555 0.000000\n0.000000 0.000000 -6.260700\nZn S\n2 2\ndirect\n0.666670 0.333340 0.000000 Zn\n0.333340 0.666670 0.500000 Zn\n0.666670 0.333340 0.625200 S\n0.333340 0.666670 0.125200 S\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Zn",
"S"
],
"chemical_system": "S-Zn",
"density": 4.0857704561130515,
"density_atomic": 0.05048543161923218,
"volume": 79.23077750762894,
"volume_molar": 11.928472366879587,
"formula_full": "Zn2 S2",
"formula_reduced": "ZnS",
"formula_anonymous": "AB",
"mineral_name": "Wurtzite",
"aflow_id": "AB_hP4_186_b_b",
"pearson_symbol": "hP4",
"strukturbericht_symbol": "B4",
"nsites_wyckoff": 2,
"spacegroup": 186
},
{
"id": 118,
"created_at": "2022-09-04T14:35:36.610582Z",
"updated_at": "2022-09-04T14:35:36.610613Z",
"structure_string": "Zr4 O8\n1.0\n5.083813 0.000000 -0.826130\n-0.000000 5.211600 0.000000\n0.000000 0.000000 5.317300\nZr O\n4 8\ndirect\n0.275400 0.039500 0.208300 Zr\n0.724600 0.539500 0.291700 Zr\n0.724600 0.960500 0.791700 Zr\n0.275400 0.460500 0.708300 Zr\n0.070000 0.331700 0.344700 O\n0.930000 0.831700 0.155300 O\n0.930000 0.668300 0.655300 O\n0.070000 0.168300 0.844700 O\n0.449600 0.756900 0.479200 O\n0.550400 0.256900 0.020800 O\n0.550400 0.243100 0.520800 O\n0.449600 0.743100 0.979200 O\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Zr",
"O"
],
"chemical_system": "O-Zr",
"density": 5.809628410527317,
"density_atomic": 0.08517839246530948,
"volume": 140.88079914031283,
"volume_molar": 7.070033356702091,
"formula_full": "Zr4 O8",
"formula_reduced": "ZrO2",
"formula_anonymous": "AB2",
"mineral_name": "Baddeleyite",
"aflow_id": "A2B_mP12_14_2e_e",
"pearson_symbol": "mP12",
"strukturbericht_symbol": "C43",
"nsites_wyckoff": 3,
"spacegroup": 14
},
{
"id": 159,
"created_at": "2022-09-04T14:35:36.692381Z",
"updated_at": "2022-09-04T14:35:36.692404Z",
"structure_string": "Mg1 Ag1 As1\n1.0\n-3.120000 -3.120000 0.000000\n-3.120000 0.000000 -3.120000\n0.000000 -3.120000 -3.120000\nAg As Mg\n1 1 1\ndirect\n0.500000 0.500000 0.500000 Ag\n0.750000 0.750000 0.750000 As\n0.000000 0.000000 0.000000 Mg\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ag",
"As",
"Mg"
],
"chemical_system": "Ag-As-Mg",
"density": 5.661408778202153,
"density_atomic": 0.0493886865928286,
"volume": 60.742656000000004,
"volume_molar": 12.193360818941954,
"formula_full": "Mg1 Ag1 As1",
"formula_reduced": "MgAgAs",
"formula_anonymous": "ABC",
"mineral_name": "half-Heusler",
"aflow_id": "ABC_cF12_216_b_c_a",
"pearson_symbol": "cF12",
"strukturbericht_symbol": "C1_b",
"nsites_wyckoff": 3,
"spacegroup": 216
},
{
"id": 187,
"created_at": "2022-09-04T14:35:36.553590Z",
"updated_at": "2022-09-04T14:35:36.553611Z",
"structure_string": "Ag2 Te8 Au2\n1.0\n0.000000 4.478000 0.000000\n5.088629 -0.000000 7.258167\n5.088629 -0.000000 -7.362633\nAg Te Au\n2 8 2\ndirect\n0.518200 0.250000 0.750000 Ag\n0.481800 0.750000 0.250000 Ag\n0.027800 0.000300 0.298300 Te\n0.027800 0.499700 0.201700 Te\n0.972200 0.999700 0.701700 Te\n0.972200 0.500300 0.798300 Te\n0.404500 0.236600 0.045500 Te\n0.404500 0.263400 0.454500 Te\n0.595500 0.763400 0.954500 Te\n0.595500 0.736600 0.545500 Te\n0.000000 0.000000 0.000000 Au\n0.000000 0.500000 0.500000 Au\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Ag",
"Te",
"Au"
],
"chemical_system": "Ag-Au-Te",
"density": 8.126541780676376,
"density_atomic": 0.03601846759224755,
"volume": 333.16242478296954,
"volume_molar": 16.719591816549624,
"formula_full": "Ag2 Te8 Au2",
"formula_reduced": "AgTe4Au",
"formula_anonymous": "ABC4",
"mineral_name": "Sylvanite",
"aflow_id": "ABC4_mP12_13_e_a_2g",
"pearson_symbol": "mP12",
"strukturbericht_symbol": "E1_b",
"nsites_wyckoff": 4,
"spacegroup": 13
},
{
"id": 31,
"created_at": "2022-09-04T14:35:37.076772Z",
"updated_at": "2022-09-04T14:35:37.076786Z",
"structure_string": "Al10 C6 N2\n1.0\n-1.640500 -2.841429 -0.000000\n-1.640500 2.841429 0.000000\n0.000000 0.000000 -21.580000\nAl C N\n10 6 2\ndirect\n0.000000 0.000000 0.845000 Al\n0.000000 0.000000 0.345000 Al\n0.000000 0.000000 0.655000 Al\n0.000000 0.000000 0.155000 Al\n0.666670 0.333340 0.955000 Al\n0.333340 0.666670 0.455000 Al\n0.666670 0.333340 0.739000 Al\n0.333340 0.666670 0.239000 Al\n0.666670 0.333340 0.545000 Al\n0.333340 0.666670 0.045000 Al\n0.000000 0.000000 0.000000 C\n0.000000 0.000000 0.500000 C\n0.000000 0.000000 0.752000 C\n0.000000 0.000000 0.252000 C\n0.666670 0.333340 0.633000 C\n0.333340 0.666670 0.133000 C\n0.666670 0.333340 0.863000 N\n0.333340 0.666670 0.363000 N\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Al",
"C",
"N"
],
"chemical_system": "Al-C-N",
"density": 3.053027486719533,
"density_atomic": 0.08947012122027644,
"volume": 201.18448208742,
"volume_molar": 6.730895943656344,
"formula_full": "Al10 C6 N2",
"formula_reduced": "Al5C3N",
"formula_anonymous": "AB3C5",
"mineral_name": "Aluminum carbonitride",
"aflow_id": "A5B3C_hP18_186_2a3b_2ab_b",
"pearson_symbol": "hP18",
"strukturbericht_symbol": "E9_4",
"nsites_wyckoff": 9,
"spacegroup": 186
},
{
"id": 232,
"created_at": "2022-09-04T14:35:36.723269Z",
"updated_at": "2022-09-04T14:35:36.723287Z",
"structure_string": "Al2 Cd1 S4\n1.0\n5.550000 -0.000000 -0.000000\n-0.000000 5.550000 0.000000\n-2.775000 -2.775000 5.150000\nAl Cd S\n2 1 4\ndirect\n0.500000 0.500000 0.000000 Al\n0.250000 0.750000 0.500000 Al\n0.000000 0.000000 0.000000 Cd\n0.390000 0.380000 0.260000 S\n0.870000 0.880000 0.260000 S\n0.120000 0.610000 0.740000 S\n0.620000 0.130000 0.740000 S\n",
"nsites": 7,
"nelements": 3,
"elements": [
"Al",
"Cd",
"S"
],
"chemical_system": "Al-Cd-S",
"density": 3.084174043635282,
"density_atomic": 0.044127044914239875,
"volume": 158.632875,
"volume_molar": 13.64727860590693,
"formula_full": "Al2 Cd1 S4",
"formula_reduced": "Al2CdS4",
"formula_anonymous": "AB2C4",
"mineral_name": null,
"aflow_id": "A2BC4_tI14_82_bc_a_g",
"pearson_symbol": "tI14",
"strukturbericht_symbol": "E3",
"nsites_wyckoff": 4,
"spacegroup": 82
},
{
"id": 263,
"created_at": "2022-09-04T14:35:36.642622Z",
"updated_at": "2022-09-04T14:35:36.642646Z",
"structure_string": "Al2 Cr4 C2\n1.0\n-1.430000 -2.476833 -0.000000\n-1.430000 2.476833 0.000000\n0.000000 0.000000 -12.820000\nAl Cr C\n2 4 2\ndirect\n0.666670 0.333340 0.250000 Al\n0.333340 0.666670 0.750000 Al\n0.666670 0.333340 0.914000 Cr\n0.333340 0.666670 0.414000 Cr\n0.333340 0.666670 0.086000 Cr\n0.666670 0.333330 0.586000 Cr\n0.000000 0.000000 0.000000 C\n0.000000 0.000000 0.500000 C\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Al",
"Cr",
"C"
],
"chemical_system": "Al-C-Cr",
"density": 5.228981243553344,
"density_atomic": 0.08809255440461683,
"volume": 90.8135773116,
"volume_molar": 6.83615181861997,
"formula_full": "Al2 Cr4 C2",
"formula_reduced": "AlCr2C",
"formula_anonymous": "ABC2",
"mineral_name": "H-Phase",
"aflow_id": "ABC2_hP8_194_d_a_f",
"pearson_symbol": "hP8",
"strukturbericht_symbol": "None",
"nsites_wyckoff": 3,
"spacegroup": 194
},
{
"id": 39,
"created_at": "2022-09-04T14:35:36.493493Z",
"updated_at": "2022-09-04T14:35:36.493514Z",
"structure_string": "Mn1 Al1 Cu2\n1.0\n-2.975000 -2.975000 0.000000\n-2.975000 0.000000 -2.975000\n0.000000 -2.975000 -2.975000\nAl Cu Mn\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Al\n0.750000 0.750000 0.750000 Cu\n0.250000 0.250000 0.250000 Cu\n0.500000 0.500000 0.500000 Mn\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Al",
"Cu",
"Mn"
],
"chemical_system": "Al-Cu-Mn",
"density": 6.590654530564426,
"density_atomic": 0.07595722421445097,
"volume": 52.66121875,
"volume_molar": 7.928331797641281,
"formula_full": "Mn1 Al1 Cu2",
"formula_reduced": "MnAlCu2",
"formula_anonymous": "ABC2",
"mineral_name": "Heusler",
"aflow_id": "AB2C_cF16_225_a_c_b",
"pearson_symbol": "cF16",
"strukturbericht_symbol": "L2_1",
"nsites_wyckoff": 3,
"spacegroup": 225
},
{
"id": 29,
"created_at": "2022-09-04T14:35:37.032321Z",
"updated_at": "2022-09-04T14:35:37.032335Z",
"structure_string": "Mg2 Al4 O8\n1.0\n-4.041600 -4.041600 0.000000\n-4.041600 0.000000 -4.041600\n0.000000 -4.041600 -4.041600\nAl Mg O\n4 2 8\ndirect\n0.500000 0.500000 0.500000 Al\n0.500000 0.500000 0.000000 Al\n0.500000 0.000000 0.500000 Al\n0.000000 0.500000 0.500000 Al\n0.875000 0.875000 0.875000 Mg\n0.125000 0.125000 0.125000 Mg\n0.262400 0.262400 0.262400 O\n0.262400 0.262400 0.712800 O\n0.262400 0.712800 0.262400 O\n0.712800 0.262400 0.262400 O\n0.737600 0.737600 0.737600 O\n0.737600 0.737600 0.287200 O\n0.737600 0.287200 0.737600 O\n0.287200 0.737600 0.737600 O\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Al",
"Mg",
"O"
],
"chemical_system": "Al-Mg-O",
"density": 3.5784029759077596,
"density_atomic": 0.10603226859736595,
"volume": 132.03527742259197,
"volume_molar": 5.6795358994607055,
"formula_full": "Mg2 Al4 O8",
"formula_reduced": "MgAl2O4",
"formula_anonymous": "AB2C4",
"mineral_name": "Spinel",
"aflow_id": "A2BC4_cF56_227_d_a_e",
"pearson_symbol": "cF56",
"strukturbericht_symbol": "H1_1",
"nsites_wyckoff": 3,
"spacegroup": 227
},
{
"id": 103,
"created_at": "2022-09-04T14:35:37.160533Z",
"updated_at": "2022-09-04T14:35:37.160551Z",
"structure_string": "Mg32 Al1 Zn48\n1.0\n-7.080000 -7.080000 7.080000\n-7.080000 7.080000 -7.080000\n7.080000 -7.080000 -7.080000\nAl Mg Zn\n1 32 48\ndirect\n0.000000 0.000000 0.000000 Al\n0.179700 0.679700 0.500000 Mg\n0.820300 0.320300 0.500000 Mg\n0.500000 0.179700 0.679700 Mg\n0.500000 0.820300 0.320300 Mg\n0.679700 0.500000 0.179700 Mg\n0.320300 0.500000 0.820300 Mg\n0.400200 0.900200 0.500000 Mg\n0.599800 0.099800 0.500000 Mg\n0.500000 0.400200 0.900200 Mg\n0.500000 0.599800 0.099800 Mg\n0.900200 0.500000 0.400200 Mg\n0.099800 0.500000 0.599800 Mg\n0.632800 0.632800 0.632800 Mg\n0.000000 0.000000 0.367200 Mg\n1.000000 0.367200 1.000000 Mg\n0.367200 0.000000 1.000000 Mg\n0.367200 0.367200 0.367200 Mg\n1.000000 1.000000 0.632800 Mg\n1.000000 0.632800 0.000000 Mg\n0.632800 0.000000 1.000000 Mg\n0.705800 0.119400 0.825200 Mg\n0.294200 0.880600 0.174800 Mg\n0.705800 0.880600 0.586400 Mg\n0.294200 0.119400 0.413600 Mg\n0.825200 0.705800 0.119400 Mg\n0.586400 0.705800 0.880600 Mg\n0.413600 0.294200 0.119400 Mg\n0.174800 0.294200 0.880600 Mg\n0.119400 0.825200 0.705800 Mg\n0.119400 0.413600 0.294200 Mg\n0.880600 0.174800 0.294200 Mg\n0.880600 0.586400 0.705800 Mg\n0.909200 0.150100 0.059300 Zn\n0.090800 0.849900 0.940700 Zn\n0.909200 0.849900 0.759100 Zn\n0.090800 0.150100 0.240900 Zn\n0.059300 0.909200 0.150100 Zn\n0.759100 0.909200 0.849900 Zn\n0.240900 0.090800 0.150100 Zn\n0.940700 0.090800 0.849900 Zn\n0.150100 0.059300 0.909200 Zn\n0.150100 0.240900 0.090800 Zn\n0.849900 0.940700 0.090800 Zn\n0.849900 0.759100 0.909200 Zn\n0.825200 0.300700 0.125900 Zn\n0.174800 0.699300 0.874100 Zn\n0.825200 0.699300 0.524500 Zn\n0.174800 0.300700 0.475500 Zn\n0.125900 0.825200 0.300700 Zn\n0.524500 0.825200 0.699300 Zn\n0.475500 0.174800 0.300700 Zn\n0.874100 0.174800 0.699300 Zn\n0.300700 0.125900 0.825200 Zn\n0.300700 0.475500 0.174800 Zn\n0.699300 0.874100 0.174800 Zn\n0.699300 0.524500 0.825200 Zn\n0.217100 0.982000 0.571100 Zn\n0.410900 0.646000 0.428900 Zn\n0.589100 0.018000 0.235100 Zn\n0.782900 0.354000 0.764900 Zn\n0.571100 0.217100 0.982000 Zn\n0.235100 0.589100 0.018000 Zn\n0.764900 0.782900 0.354000 Zn\n0.428900 0.410900 0.646000 Zn\n0.982000 0.571100 0.217100 Zn\n0.354000 0.764900 0.782900 Zn\n0.646000 0.428900 0.410900 Zn\n0.018000 0.235100 0.589100 Zn\n0.782900 0.018000 0.428900 Zn\n0.589100 0.354000 0.571100 Zn\n0.410900 0.982000 0.764900 Zn\n0.217100 0.646000 0.235100 Zn\n0.428900 0.782900 0.018000 Zn\n0.764900 0.410900 0.982000 Zn\n0.235100 0.217100 0.646000 Zn\n0.571100 0.589100 0.354000 Zn\n0.018000 0.428900 0.782900 Zn\n0.646000 0.235100 0.217100 Zn\n0.354000 0.571100 0.589100 Zn\n0.982000 0.764900 0.410900 Zn\n",
"nsites": 81,
"nelements": 3,
"elements": [
"Al",
"Mg",
"Zn"
],
"chemical_system": "Al-Mg-Zn",
"density": 4.613891417319462,
"density_atomic": 0.057059144313683474,
"volume": 1419.5796480000001,
"volume_molar": 10.554207975663273,
"formula_full": "Mg32 Al1 Zn48",
"formula_reduced": "Mg32AlZn48",
"formula_anonymous": "AB32C48",
"mineral_name": "Bergman Structure: Mg32(Al,Zn)49 Bergman",
"aflow_id": "AB32C48_cI162_204_a_2efg_2gh",
"pearson_symbol": "cI162",
"strukturbericht_symbol": "None",
"nsites_wyckoff": 8,
"spacegroup": 204
},
{
"id": 160,
"created_at": "2022-09-04T14:35:36.709740Z",
"updated_at": "2022-09-04T14:35:36.709755Z",
"structure_string": "Al2 P2 S8\n1.0\n5.610000 0.000000 0.000000\n-0.000000 5.670000 0.000000\n0.000000 0.000000 9.050000\nAl P S\n2 2 8\ndirect\n0.000000 0.000000 0.000000 Al\n0.000000 0.500000 0.500000 Al\n0.000000 0.500000 0.000000 P\n0.000000 0.000000 0.500000 P\n0.200000 0.260000 0.125000 S\n0.200000 0.740000 0.875000 S\n0.800000 0.260000 0.875000 S\n0.800000 0.740000 0.125000 S\n0.740000 0.800000 0.630000 S\n0.740000 0.200000 0.370000 S\n0.260000 0.800000 0.370000 S\n0.260000 0.200000 0.630000 S\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Al",
"P",
"S"
],
"chemical_system": "Al-P-S",
"density": 2.148324870673867,
"density_atomic": 0.04168566621171973,
"volume": 287.868735,
"volume_molar": 14.446550354776157,
"formula_full": "Al2 P2 S8",
"formula_reduced": "AlPS4",
"formula_anonymous": "ABC4",
"mineral_name": null,
"aflow_id": "ABC4_oP12_16_ag_cd_2u",
"pearson_symbol": "oP12",
"strukturbericht_symbol": "None",
"nsites_wyckoff": 6,
"spacegroup": 16
}
]
}