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=aflow_id&page=3",
"previous": "https://simmate.org/third-parties/AflowPrototype/?format=api&ordering=aflow_id",
"results": [
{
"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": 15,
"created_at": "2022-09-04T14:35:36.709357Z",
"updated_at": "2022-09-04T14:35:36.709388Z",
"structure_string": "Fe1 Cu2 Sn1 S4\n1.0\n5.460000 -0.000000 -0.000000\n-0.000000 5.460000 0.000000\n-2.730000 -2.730000 5.362500\nCu Fe S Sn\n2 1 4 1\ndirect\n0.250000 0.750000 0.500000 Cu\n0.750000 0.250000 0.500000 Cu\n0.000000 0.000000 0.000000 Fe\n0.377000 0.377000 0.264000 S\n0.113000 0.623000 0.736000 S\n0.623000 0.113000 0.736000 S\n0.887000 0.887000 0.264000 S\n0.500000 0.500000 0.000000 Sn\n",
"nsites": 8,
"nelements": 4,
"elements": [
"Cu",
"Fe",
"S",
"Sn"
],
"chemical_system": "Cu-Fe-S-Sn",
"density": 4.46550956012965,
"density_atomic": 0.05004231546919628,
"volume": 159.864705,
"volume_molar": 12.034096950823447,
"formula_full": "Fe1 Cu2 Sn1 S4",
"formula_reduced": "FeCu2SnS4",
"formula_anonymous": "ABC2D4",
"mineral_name": "Stannite",
"aflow_id": "A2BC4D_tI16_121_d_a_i_b",
"pearson_symbol": "tI16",
"strukturbericht_symbol": "H2_6",
"nsites_wyckoff": 4,
"spacegroup": 121
},
{
"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": 94,
"created_at": "2022-09-04T14:35:36.993341Z",
"updated_at": "2022-09-04T14:35:36.993358Z",
"structure_string": "Si2 O4\n1.0\n-3.583000 -3.583000 0.000000\n-3.583000 0.000000 -3.583000\n0.000000 -3.583000 -3.583000\nO Si\n4 2\ndirect\n0.000000 0.000000 0.000000 O\n0.000000 0.000000 0.500000 O\n0.000000 0.500000 1.000000 O\n0.500000 1.000000 1.000000 O\n0.875000 0.875000 0.875000 Si\n0.125000 0.125000 0.125000 Si\n",
"nsites": 6,
"nelements": 2,
"elements": [
"O",
"Si"
],
"chemical_system": "O-Si",
"density": 2.1690505770882824,
"density_atomic": 0.06522000536895127,
"volume": 91.99631257400002,
"volume_molar": 9.233579062026433,
"formula_full": "Si2 O4",
"formula_reduced": "SiO2",
"formula_anonymous": "AB2",
"mineral_name": "high (beta) Cristobalite",
"aflow_id": "A2B_cF24_227_c_a",
"pearson_symbol": "cF24",
"strukturbericht_symbol": "C9",
"nsites_wyckoff": 2,
"spacegroup": 227
},
{
"id": 276,
"created_at": "2022-09-04T14:35:36.916251Z",
"updated_at": "2022-09-04T14:35:36.916281Z",
"structure_string": "Mg2 Cu4\n1.0\n-3.510000 -3.510000 0.000000\n-3.510000 0.000000 -3.510000\n0.000000 -3.510000 -3.510000\nCu Mg\n4 2\ndirect\n0.500000 0.500000 0.500000 Cu\n0.500000 0.500000 1.000000 Cu\n0.500000 0.000000 0.500000 Cu\n0.000000 0.500000 0.500000 Cu\n0.875000 0.875000 0.875000 Mg\n0.125000 0.125000 0.125000 Mg\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Cu",
"Mg"
],
"chemical_system": "Cu-Mg",
"density": 5.813598265000027,
"density_atomic": 0.0693745062703107,
"volume": 86.48710199999998,
"volume_molar": 8.68062503614129,
"formula_full": "Mg2 Cu4",
"formula_reduced": "MgCu2",
"formula_anonymous": "AB2",
"mineral_name": "Cubic Laves",
"aflow_id": "A2B_cF24_227_d_a",
"pearson_symbol": "cF24",
"strukturbericht_symbol": "C15",
"nsites_wyckoff": 2,
"spacegroup": 227
},
{
"id": 78,
"created_at": "2022-09-04T14:35:36.545402Z",
"updated_at": "2022-09-04T14:35:36.545425Z",
"structure_string": "Ce1 Ni1 C2\n1.0\n0.000000 -2.276000 -3.081000\n0.000000 -2.276000 3.081000\n-3.875000 0.000000 -0.000000\nC Ce Ni\n2 1 1\ndirect\n0.553600 0.136400 0.500000 C\n0.863600 0.446400 0.500000 C\n0.000000 0.000000 0.000000 Ce\n0.385600 0.614400 0.500000 Ni\n",
"nsites": 4,
"nelements": 3,
"elements": [
"C",
"Ce",
"Ni"
],
"chemical_system": "C-Ce-Ni",
"density": 6.808613136523336,
"density_atomic": 0.07360279943831496,
"volume": 54.345758999999994,
"volume_molar": 8.18194526017592,
"formula_full": "Ce1 Ni1 C2",
"formula_reduced": "CeNiC2",
"formula_anonymous": "ABC2",
"mineral_name": null,
"aflow_id": "A2BC_oC8_38_e_a_b",
"pearson_symbol": "oC8",
"strukturbericht_symbol": "None",
"nsites_wyckoff": 3,
"spacegroup": 38
},
{
"id": 114,
"created_at": "2022-09-04T14:35:36.536722Z",
"updated_at": "2022-09-04T14:35:36.536739Z",
"structure_string": "Cu4 O2\n1.0\n4.267000 0.000000 0.000000\n-0.000000 4.267000 0.000000\n0.000000 0.000000 4.267000\nCu O\n4 2\ndirect\n0.000000 0.000000 0.000000 Cu\n0.000000 0.500000 0.500000 Cu\n0.500000 0.000000 0.500000 Cu\n0.500000 0.500000 0.000000 Cu\n0.250000 0.250000 0.250000 O\n0.750000 0.750000 0.750000 O\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Cu",
"O"
],
"chemical_system": "Cu-O",
"density": 6.11680586890705,
"density_atomic": 0.07722951754657972,
"volume": 77.69050216300002,
"volume_molar": 7.797718995677844,
"formula_full": "Cu4 O2",
"formula_reduced": "Cu2O",
"formula_anonymous": "AB2",
"mineral_name": "Cuprite",
"aflow_id": "A2B_cP6_224_b_a",
"pearson_symbol": "cP6",
"strukturbericht_symbol": "C3",
"nsites_wyckoff": 2,
"spacegroup": 224
},
{
"id": 147,
"created_at": "2022-09-04T14:35:36.454572Z",
"updated_at": "2022-09-04T14:35:36.454600Z",
"structure_string": "Si4 O8\n1.0\n-2.526000 -4.375160 -0.000000\n-2.526000 4.375160 0.000000\n0.000000 0.000000 -8.270000\nSi O\n4 8\ndirect\n0.666670 0.333340 0.938000 Si\n0.333340 0.666670 0.438000 Si\n0.333340 0.666670 0.062000 Si\n0.666670 0.333330 0.562000 Si\n0.666670 0.333340 0.750000 O\n0.333340 0.666670 0.250000 O\n0.500000 0.500000 1.000000 O\n0.500000 1.000000 0.500000 O\n0.000000 0.500000 0.000000 O\n0.500000 0.500000 0.500000 O\n0.500000 1.000000 1.000000 O\n0.000000 0.500000 0.500000 O\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Si",
"O"
],
"chemical_system": "O-Si",
"density": 2.1832692769073314,
"density_atomic": 0.06564753974197762,
"volume": 182.7943598064,
"volume_molar": 9.173444707401893,
"formula_full": "Si4 O8",
"formula_reduced": "SiO2",
"formula_anonymous": "AB2",
"mineral_name": "beta Tridymite",
"aflow_id": "A2B_hP12_194_cg_f",
"pearson_symbol": "hP12",
"strukturbericht_symbol": "C10",
"nsites_wyckoff": 3,
"spacegroup": 194
},
{
"id": 238,
"created_at": "2022-09-04T14:35:36.832832Z",
"updated_at": "2022-09-04T14:35:36.832854Z",
"structure_string": "Mg12 Ni6\n1.0\n-2.599000 -4.501600 -0.000000\n-2.599000 4.501600 0.000000\n0.000000 0.000000 -13.210000\nMg Ni\n12 6\ndirect\n0.500000 0.500000 0.837000 Mg\n0.500000 1.000000 0.503667 Mg\n1.000000 0.500000 0.170333 Mg\n0.500000 0.500000 0.163000 Mg\n0.500000 1.000000 0.829667 Mg\n1.000000 0.500000 0.496333 Mg\n0.885900 0.114100 0.000000 Mg\n0.114100 0.228200 0.666667 Mg\n0.228200 0.114100 0.333333 Mg\n0.114100 0.885900 1.000000 Mg\n0.885900 0.771800 0.666667 Mg\n0.771800 0.885900 0.333333 Mg\n0.000000 0.000000 0.500000 Ni\n0.000000 0.000000 0.166667 Ni\n0.000000 0.000000 0.833333 Ni\n0.500000 0.500000 0.500000 Ni\n0.500000 1.000000 0.166667 Ni\n1.000000 0.500000 0.833333 Ni\n",
"nsites": 18,
"nelements": 2,
"elements": [
"Mg",
"Ni"
],
"chemical_system": "Mg-Ni",
"density": 3.4586597201260245,
"density_atomic": 0.05823264411772327,
"volume": 309.10497492800005,
"volume_molar": 10.341520381292705,
"formula_full": "Mg12 Ni6",
"formula_reduced": "Mg2Ni",
"formula_anonymous": "AB2",
"mineral_name": null,
"aflow_id": "A2B_hP18_180_fi_bd",
"pearson_symbol": "hP18",
"strukturbericht_symbol": "C_a",
"nsites_wyckoff": 4,
"spacegroup": 180
},
{
"id": 251,
"created_at": "2022-09-04T14:35:37.138470Z",
"updated_at": "2022-09-04T14:35:37.138488Z",
"structure_string": "Cu4 Te2\n1.0\n-2.118500 -3.669350 -0.000000\n-2.118500 3.669350 0.000000\n0.000000 0.000000 -7.247000\nCu Te\n4 2\ndirect\n0.666670 0.333340 0.840000 Cu\n0.333340 0.666670 0.840000 Cu\n0.333340 0.666670 0.160000 Cu\n0.666670 0.333330 0.160000 Cu\n0.000000 0.000000 0.694000 Te\n0.000000 0.000000 0.306000 Te\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Cu",
"Te"
],
"chemical_system": "Cu-Te",
"density": 7.507382311910251,
"density_atomic": 0.053253160331398174,
"volume": 112.66936952965001,
"volume_molar": 11.308513377466792,
"formula_full": "Cu4 Te2",
"formula_reduced": "Cu2Te",
"formula_anonymous": "AB2",
"mineral_name": null,
"aflow_id": "A2B_hP6_191_h_e",
"pearson_symbol": "hP6",
"strukturbericht_symbol": "C_h",
"nsites_wyckoff": 2,
"spacegroup": 191
},
{
"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": 180,
"created_at": "2022-09-04T14:35:37.141239Z",
"updated_at": "2022-09-04T14:35:37.141258Z",
"structure_string": "Fe6 P3\n1.0\n0.000000 0.000000 -3.450000\n-2.925000 -5.066249 -0.000000\n-2.925000 5.066249 0.000000\nFe P\n6 3\ndirect\n1.000000 0.740000 0.740000 Fe\n0.000000 1.000000 0.260000 Fe\n1.000000 0.260000 0.000000 Fe\n0.500000 0.400000 0.400000 Fe\n0.500000 1.000000 0.600000 Fe\n0.500000 0.600000 0.000000 Fe\n0.500000 0.000000 0.000000 P\n0.125000 0.666670 0.333340 P\n0.875000 0.333340 0.666670 P\n",
"nsites": 9,
"nelements": 2,
"elements": [
"Fe",
"P"
],
"chemical_system": "Fe-P",
"density": 6.950603777519372,
"density_atomic": 0.08801992967844442,
"volume": 102.2495704425,
"volume_molar": 6.841792287269672,
"formula_full": "Fe6 P3",
"formula_reduced": "Fe2P",
"formula_anonymous": "AB2",
"mineral_name": null,
"aflow_id": "A2B_hP9_150_ef_bd",
"pearson_symbol": "hP9",
"strukturbericht_symbol": "C22",
"nsites_wyckoff": 4,
"spacegroup": 150
}
]
}