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=elements&page=85",
"previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=elements&page=83",
"results": [
{
"id": "mp-32884",
"created_at": "2022-09-04T14:48:24.551475Z",
"structure_string": "Ag4 S2\n1.0\n-4.241457 0.000000 0.000000\n-1.570822 -3.963611 0.000000\n-0.054000 -0.101361 7.678790\nAg S\n4 2\ndirect\n0.763461 0.720585 0.739290 Ag\n0.369517 0.321353 0.971102 Ag\n0.154253 0.119195 0.506593 Ag\n0.755153 0.714465 0.238191 Ag\n0.543361 0.510981 0.492555 S\n0.976755 0.925920 0.989771 S\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Ag",
"S"
],
"chemical_system": "Ag-S",
"density": 6.3750554217582565,
"density_atomic": 0.04647852810665719,
"volume": 129.0918676734217,
"volume_molar": 12.956823301677318,
"formula_full": "Ag4 S2",
"formula_reduced": "Ag2S",
"formula_anonymous": "AB2",
"energy": -20.90467095,
"energy_per_atom": -3.484111825,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -19.89867095,
"band_gap": 1.4428,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0009781,
"is_theoretical": true,
"updated_at": "2021-11-28T01:39:20.149000Z",
"spacegroup": 2
},
{
"id": "mp-556225",
"created_at": "2022-09-04T14:47:43.366202Z",
"structure_string": "Ag4 S2\n1.0\n7.549481 0.000000 0.000000\n0.000000 4.223035 0.000000\n0.000000 1.487861 3.968908\nAg S\n4 2\ndirect\n0.750000 0.130570 0.108110 Ag\n0.250000 0.869430 0.891890 Ag\n0.000000 0.500000 0.500000 Ag\n0.500000 0.500000 0.500000 Ag\n0.750000 0.736430 0.710199 S\n0.250000 0.263570 0.289801 S\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Ag",
"S"
],
"chemical_system": "Ag-S",
"density": 6.5038428577667515,
"density_atomic": 0.047417476879380825,
"volume": 126.5356234635306,
"volume_molar": 12.700255594195667,
"formula_full": "Ag4 S2",
"formula_reduced": "Ag2S",
"formula_anonymous": "AB2",
"energy": -20.89083048,
"energy_per_atom": -3.4818050800000004,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -19.88483048,
"band_gap": 1.1894,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.001806,
"is_theoretical": true,
"updated_at": "2021-11-28T01:38:21.820000Z",
"spacegroup": 11
},
{
"id": "mp-1229090",
"created_at": "2022-09-04T14:44:07.409212Z",
"structure_string": "Ag2 S1\n1.0\n0.000000 3.123988 3.123988\n3.123988 0.000000 3.123988\n3.123988 3.123988 0.000000\nAg S\n2 1\ndirect\n0.750000 0.750000 0.750000 Ag\n0.250000 0.250000 0.250000 Ag\n0.000000 0.000000 0.000000 S\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Ag",
"S"
],
"chemical_system": "Ag-S",
"density": 6.748306298659036,
"density_atomic": 0.049199783095854224,
"volume": 60.97587857562714,
"volume_molar": 12.240177458236497,
"formula_full": "Ag2 S1",
"formula_reduced": "Ag2S",
"formula_anonymous": "AB2",
"energy": -10.25337676,
"energy_per_atom": -3.4177922533333334,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -9.75037676,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 3.52e-05,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:37.911000Z",
"spacegroup": 225
},
{
"id": "mp-32669",
"created_at": "2022-09-04T14:45:43.183489Z",
"structure_string": "Ag4 S2\n1.0\n2.390031 -3.531984 0.000000\n2.390031 3.531984 0.000000\n0.000000 0.000000 7.589422\nAg S\n4 2\ndirect\n0.493457 0.506543 0.691216 Ag\n0.506543 0.493457 0.191216 Ag\n0.105995 0.894005 0.935349 Ag\n0.894005 0.105995 0.435349 Ag\n0.283290 0.716710 0.436182 S\n0.716710 0.283290 0.936182 S\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Ag",
"S"
],
"chemical_system": "Ag-S",
"density": 6.422762894340639,
"density_atomic": 0.04682634831505096,
"volume": 128.132989564584,
"volume_molar": 12.8605816526256,
"formula_full": "Ag4 S2",
"formula_reduced": "Ag2S",
"formula_anonymous": "AB2",
"energy": -20.90880487,
"energy_per_atom": -3.4848008116666667,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -19.90280487,
"band_gap": 1.3001000000000005,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:12.657000Z",
"spacegroup": 36
},
{
"id": "mp-560025",
"created_at": "2022-09-04T14:39:17.951290Z",
"structure_string": "Ag4 S2\n1.0\n6.506144 0.000000 0.000000\n0.000000 4.256782 0.000000\n0.000000 1.067581 4.602364\nAg S\n4 2\ndirect\n0.501857 0.470079 0.522282 Ag\n0.368726 0.859998 0.929639 Ag\n0.868726 0.140002 0.070361 Ag\n0.001857 0.529921 0.477718 Ag\n0.254416 0.284553 0.210962 S\n0.754416 0.715447 0.789038 S\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Ag",
"S"
],
"chemical_system": "Ag-S",
"density": 6.45649477801871,
"density_atomic": 0.047072276891337646,
"volume": 127.46356021508139,
"volume_molar": 12.793391689765933,
"formula_full": "Ag4 S2",
"formula_reduced": "Ag2S",
"formula_anonymous": "AB2",
"energy": -20.43479722,
"energy_per_atom": -3.4057995366666667,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -19.42879722,
"band_gap": 0.3700999999999999,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0012459,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:41.257000Z",
"spacegroup": 4
},
{
"id": "mp-32791",
"created_at": "2022-09-04T14:45:22.333931Z",
"structure_string": "Ag4 S2\n1.0\n2.435413 -3.562835 0.000000\n2.435413 3.562835 0.000000\n0.000000 0.000000 6.778480\nAg S\n4 2\ndirect\n0.342261 0.657739 0.863549 Ag\n0.157739 0.842261 0.363549 Ag\n0.842261 0.157739 0.636451 Ag\n0.657739 0.342261 0.136451 Ag\n0.000000 0.000000 0.000000 S\n0.500000 0.500000 0.500000 S\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Ag",
"S"
],
"chemical_system": "Ag-S",
"density": 6.996038716042829,
"density_atomic": 0.05100592239387574,
"volume": 117.6333986015792,
"volume_molar": 11.806748074264952,
"formula_full": "Ag4 S2",
"formula_reduced": "Ag2S",
"formula_anonymous": "AB2",
"energy": -20.40417584,
"energy_per_atom": -3.4006959733333333,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -19.39817584,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 3.3e-06,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:10.251000Z",
"spacegroup": 64
},
{
"id": "mp-36216",
"created_at": "2022-09-04T14:39:26.096950Z",
"structure_string": "Ag4 S2\n1.0\n2.409435 -3.484429 0.000000\n2.409435 3.484429 0.000000\n0.000000 0.000000 7.577337\nAg S\n4 2\ndirect\n0.500000 0.500000 0.000000 Ag\n0.500000 0.500000 0.500000 Ag\n0.879892 0.120108 0.250000 Ag\n0.120108 0.879892 0.750000 Ag\n0.279710 0.720290 0.250000 S\n0.720290 0.279710 0.750000 S\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Ag",
"S"
],
"chemical_system": "Ag-S",
"density": 6.468289004213283,
"density_atomic": 0.04715826489260424,
"volume": 127.23114418361418,
"volume_molar": 12.770064322159664,
"formula_full": "Ag4 S2",
"formula_reduced": "Ag2S",
"formula_anonymous": "AB2",
"energy": -20.8947524,
"energy_per_atom": -3.4824587333333334,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -19.8887524,
"band_gap": 1.2959,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0008845,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:24.182000Z",
"spacegroup": 63
},
{
"id": "mp-1183254",
"created_at": "2022-09-04T14:39:10.569697Z",
"structure_string": "Ag6 S2\n1.0\n2.987769 -5.174967 0.000000\n2.987769 5.174967 0.000000\n0.000000 0.000000 4.671398\nAg S\n6 2\ndirect\n0.164942 0.329884 0.250000 Ag\n0.670116 0.835058 0.250000 Ag\n0.164942 0.835058 0.250000 Ag\n0.835058 0.670116 0.750000 Ag\n0.329884 0.164942 0.750000 Ag\n0.835058 0.164942 0.750000 Ag\n0.333333 0.666667 0.750000 S\n0.666667 0.333333 0.250000 S\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Ag",
"S"
],
"chemical_system": "Ag-S",
"density": 8.177007044993303,
"density_atomic": 0.055380710004429595,
"volume": 144.45463049065503,
"volume_molar": 10.874076478106405,
"formula_full": "Ag6 S2",
"formula_reduced": "Ag3S",
"formula_anonymous": "AB3",
"energy": -25.43343909,
"energy_per_atom": -3.17917988625,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -24.42743909,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0002907,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:32.417000Z",
"spacegroup": 194
},
{
"id": "mp-610517",
"created_at": "2022-09-04T14:44:19.696056Z",
"structure_string": "Ag8 S4\n1.0\n7.401795 0.000000 0.000000\n0.000000 4.361136 0.000000\n0.000000 2.839211 7.639011\nAg S\n8 4\ndirect\n0.508813 0.477457 0.793587 Ag\n0.491187 0.522543 0.206413 Ag\n0.693029 0.855329 0.442909 Ag\n0.008813 0.522543 0.706413 Ag\n0.991187 0.477457 0.293587 Ag\n0.306971 0.144671 0.557091 Ag\n0.806971 0.855329 0.942909 Ag\n0.193029 0.144671 0.057091 Ag\n0.763344 0.260309 0.140539 S\n0.263344 0.739691 0.359461 S\n0.236656 0.739691 0.859461 S\n0.736656 0.260309 0.640539 S\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Ag",
"S"
],
"chemical_system": "Ag-S",
"density": 6.6748118178190365,
"density_atomic": 0.048663957904162954,
"volume": 246.58906749081873,
"volume_molar": 12.374950619223753,
"formula_full": "Ag8 S4",
"formula_reduced": "Ag2S",
"formula_anonymous": "AB2",
"energy": -41.58832246,
"energy_per_atom": -3.4656935383333334,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -39.57632246,
"band_gap": 1.0006999999999997,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0031848,
"is_theoretical": false,
"updated_at": "2021-11-28T01:36:22.504000Z",
"spacegroup": 14
},
{
"id": "mp-31053",
"created_at": "2022-09-04T14:39:08.715243Z",
"structure_string": "Ag4 S2\n1.0\n5.898564 0.000000 0.000000\n0.000000 4.345211 0.000000\n0.000000 1.525316 5.711098\nAg S\n4 2\ndirect\n0.454175 0.905926 0.008632 Ag\n0.954175 0.094074 0.991368 Ag\n0.524640 0.983198 0.491245 Ag\n0.024640 0.016802 0.508755 Ag\n0.771185 0.705837 0.804535 S\n0.271185 0.294163 0.195465 S\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Ag",
"S"
],
"chemical_system": "Ag-S",
"density": 5.62219714213187,
"density_atomic": 0.04098967469363167,
"volume": 146.3783268553772,
"volume_molar": 14.691848142272828,
"formula_full": "Ag4 S2",
"formula_reduced": "Ag2S",
"formula_anonymous": "AB2",
"energy": -20.93920786,
"energy_per_atom": -3.4898679766666665,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -19.93320786,
"band_gap": 1.5919,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0017598,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:27.341000Z",
"spacegroup": 4
},
{
"id": "mp-16240",
"created_at": "2022-09-04T14:48:05.634912Z",
"structure_string": "Ag6 Sb2\n1.0\n4.948358 0.000000 0.000000\n0.000000 5.318272 0.000000\n0.000000 0.000000 6.084502\nAg Sb\n6 2\ndirect\n0.500000 0.329829 0.000000 Ag\n0.000000 0.670171 0.500000 Ag\n0.000000 0.155892 0.252233 Ag\n0.500000 0.844108 0.247767 Ag\n0.000000 0.155892 0.747767 Ag\n0.500000 0.844108 0.752233 Ag\n0.000000 0.669053 0.000000 Sb\n0.500000 0.330947 0.500000 Sb\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Ag",
"Sb"
],
"chemical_system": "Ag-Sb",
"density": 9.237152029562061,
"density_atomic": 0.049961249513559056,
"volume": 160.12409773356185,
"volume_molar": 12.05362319524383,
"formula_full": "Ag6 Sb2",
"formula_reduced": "Ag3Sb",
"formula_anonymous": "AB3",
"energy": -25.44295406,
"energy_per_atom": -3.1803692575,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -25.05895406,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0006814,
"is_theoretical": false,
"updated_at": "2021-11-28T01:38:24.906000Z",
"spacegroup": 59
},
{
"id": "mp-2273",
"created_at": "2022-09-04T14:40:36.232721Z",
"structure_string": "Ag3 Sb1\n1.0\n3.259365 0.000000 0.000000\n0.000000 4.813736 0.000000\n0.000000 0.000000 5.167705\nAg Sb\n3 1\ndirect\n0.500000 0.500000 0.830887 Ag\n0.000000 0.500000 0.349095 Ag\n0.500000 0.000000 0.497296 Ag\n0.000000 0.000000 0.002722 Sb\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ag",
"Sb"
],
"chemical_system": "Ag-Sb",
"density": 9.121196488250495,
"density_atomic": 0.04933407744651866,
"volume": 81.0798581231454,
"volume_molar": 12.206857960460276,
"formula_full": "Ag3 Sb1",
"formula_reduced": "Ag3Sb",
"formula_anonymous": "AB3",
"energy": -12.51787929,
"energy_per_atom": -3.1294698225,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -12.32587929,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.001149,
"is_theoretical": false,
"updated_at": "2021-11-28T01:35:06.083000Z",
"spacegroup": 25
}
]
}