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=12174",
"previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=-elements&page=12172",
"results": [
{
"id": "mp-1181265",
"created_at": "2022-09-04T14:41:19.239506Z",
"structure_string": "H16\n1.0\n6.061511 0.000000 0.000000\n0.000000 6.507494 0.000000\n0.000000 0.000000 9.083183\nH\n16\ndirect\n0.750000 0.114251 0.817708 H\n0.750000 0.385749 0.317708 H\n0.250000 0.885749 0.182292 H\n0.250000 0.614251 0.682292 H\n0.750000 0.204237 0.049089 H\n0.750000 0.295763 0.549089 H\n0.250000 0.795763 0.950911 H\n0.250000 0.704237 0.450911 H\n0.903664 0.205616 0.044758 H\n0.596336 0.294384 0.544758 H\n0.403664 0.794384 0.955242 H\n0.096336 0.705616 0.455242 H\n0.096336 0.794384 0.955242 H\n0.403664 0.705616 0.455242 H\n0.596336 0.205616 0.044758 H\n0.903664 0.294384 0.544758 H\n",
"nsites": 16,
"nelements": 1,
"elements": [
"H"
],
"chemical_system": "H",
"density": 0.07474308556607644,
"density_atomic": 0.04465676352473224,
"volume": 358.28839210747384,
"volume_molar": 13.485394562158001,
"formula_full": "H16",
"formula_reduced": "H",
"formula_anonymous": "A",
"energy": -35.19699029,
"energy_per_atom": -2.199811893125,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -35.19699029,
"band_gap": 1.5177999999999998,
"is_gap_direct": true,
"is_magnetic": true,
"total_magnetization": 0.0,
"is_theoretical": false,
"updated_at": "2021-11-28T01:35:15.321000Z",
"spacegroup": 62
},
{
"id": "mp-128",
"created_at": "2022-09-04T14:41:48.483009Z",
"structure_string": "Ge8\n1.0\n3.511326 -5.012402 0.000000\n3.511326 5.012402 0.000000\n-3.643856 0.000000 4.916898\nGe\n8\ndirect\n0.285519 0.285519 0.285519 Ge\n0.714481 0.714481 0.714481 Ge\n0.973070 0.469947 0.278233 Ge\n0.469947 0.278233 0.973070 Ge\n0.278233 0.973070 0.469947 Ge\n0.026930 0.530053 0.721767 Ge\n0.530053 0.721767 0.026930 Ge\n0.721767 0.026930 0.530053 Ge\n",
"nsites": 8,
"nelements": 1,
"elements": [
"Ge"
],
"chemical_system": "Ge",
"density": 5.575408314245141,
"density_atomic": 0.04622232058708929,
"volume": 173.07655475511848,
"volume_molar": 13.028642187389636,
"formula_full": "Ge8",
"formula_reduced": "Ge",
"formula_anonymous": "A",
"energy": -35.80346761,
"energy_per_atom": -4.47543345125,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -35.80346761,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0058594,
"is_theoretical": false,
"updated_at": "2021-11-28T01:35:38.585000Z",
"spacegroup": 148
},
{
"id": "mp-1198022",
"created_at": "2022-09-04T14:40:06.625836Z",
"structure_string": "Ge34\n1.0\n0.000000 7.726817 7.726817\n7.726817 0.000000 7.726817\n7.726817 7.726817 0.000000\nGe\n34\ndirect\n0.500000 0.500000 0.500000 Ge\n0.750000 0.750000 0.750000 Ge\n0.473715 0.842095 0.842095 Ge\n0.842095 0.473715 0.842095 Ge\n0.842095 0.842095 0.473715 Ge\n0.842095 0.842095 0.842095 Ge\n0.776285 0.407905 0.407905 Ge\n0.407905 0.776285 0.407905 Ge\n0.407905 0.407905 0.776285 Ge\n0.407905 0.407905 0.407905 Ge\n0.389344 0.995453 0.995453 Ge\n0.995453 0.389344 0.619749 Ge\n0.995453 0.619749 0.389344 Ge\n0.619749 0.995453 0.995453 Ge\n0.995453 0.995453 0.389344 Ge\n0.389344 0.619749 0.995453 Ge\n0.619749 0.389344 0.995453 Ge\n0.995453 0.995453 0.619749 Ge\n0.995453 0.389344 0.995453 Ge\n0.619749 0.995453 0.389344 Ge\n0.389344 0.995453 0.619749 Ge\n0.995453 0.619749 0.995453 Ge\n0.860656 0.254547 0.254547 Ge\n0.254547 0.860656 0.630251 Ge\n0.254547 0.630251 0.860656 Ge\n0.630251 0.254547 0.254547 Ge\n0.254547 0.254547 0.860656 Ge\n0.860656 0.630251 0.254547 Ge\n0.630251 0.860656 0.254547 Ge\n0.254547 0.254547 0.630251 Ge\n0.254547 0.860656 0.254547 Ge\n0.630251 0.254547 0.860656 Ge\n0.860656 0.254547 0.630251 Ge\n0.254547 0.630251 0.254547 Ge\n",
"nsites": 34,
"nelements": 1,
"elements": [
"Ge"
],
"chemical_system": "Ge",
"density": 4.445002140288905,
"density_atomic": 0.03685081026510414,
"volume": 922.6391429497627,
"volume_molar": 16.34194938096833,
"formula_full": "Ge34",
"formula_reduced": "Ge",
"formula_anonymous": "A",
"energy": -156.33740326,
"energy_per_atom": -4.598158919411765,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -156.33740326,
"band_gap": 1.1428,
"is_gap_direct": true,
"is_magnetic": false,
"total_magnetization": 0.0031995,
"is_theoretical": false,
"updated_at": "2021-11-28T01:34:48.280000Z",
"spacegroup": 227
},
{
"id": "mp-137",
"created_at": "2022-09-04T14:39:17.941879Z",
"structure_string": "Ge12\n1.0\n6.026650 0.000000 0.000000\n0.000000 6.026650 0.000000\n0.000000 0.000000 7.105868\nGe\n12\ndirect\n0.087648 0.087648 0.000000 Ge\n0.412352 0.587648 0.750000 Ge\n0.587648 0.412352 0.250000 Ge\n0.912352 0.912352 0.500000 Ge\n0.171399 0.370395 0.253228 Ge\n0.129605 0.671399 0.003228 Ge\n0.870395 0.328601 0.503228 Ge\n0.671399 0.129605 0.996772 Ge\n0.328601 0.870395 0.496772 Ge\n0.828601 0.629605 0.753228 Ge\n0.370395 0.171399 0.746772 Ge\n0.629605 0.828601 0.246772 Ge\n",
"nsites": 12,
"nelements": 1,
"elements": [
"Ge"
],
"chemical_system": "Ge",
"density": 5.608375747078466,
"density_atomic": 0.04649563352911399,
"volume": 258.0887513337356,
"volume_molar": 12.952056575869946,
"formula_full": "Ge12",
"formula_reduced": "Ge",
"formula_anonymous": "A",
"energy": -53.68365537999999,
"energy_per_atom": -4.473637948333333,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -53.68365537999999,
"band_gap": 0.3433000000000001,
"is_gap_direct": true,
"is_magnetic": false,
"total_magnetization": 0.0044362,
"is_theoretical": false,
"updated_at": "2021-11-28T01:34:37.185000Z",
"spacegroup": 96
},
{
"id": "mp-1080106",
"created_at": "2022-09-04T14:42:51.799059Z",
"structure_string": "Ge8\n1.0\n-3.523808 3.523808 3.523808\n3.523808 -3.523808 3.523808\n3.523808 3.523808 -3.523808\nGe\n8\ndirect\n0.500000 0.000000 0.798226 Ge\n0.798226 0.500000 0.000000 Ge\n0.000000 0.798226 0.500000 Ge\n0.701774 0.701774 0.701774 Ge\n0.500000 0.000000 0.201774 Ge\n0.201774 0.500000 0.000000 Ge\n0.000000 0.201774 0.500000 Ge\n0.298226 0.298226 0.298226 Ge\n",
"nsites": 8,
"nelements": 1,
"elements": [
"Ge"
],
"chemical_system": "Ge",
"density": 5.51338368875929,
"density_atomic": 0.04570811212702437,
"volume": 175.0236364557725,
"volume_molar": 13.17521218829662,
"formula_full": "Ge8",
"formula_reduced": "Ge",
"formula_anonymous": "A",
"energy": -35.81940783,
"energy_per_atom": -4.47742597875,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -35.81940783,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 8e-06,
"is_theoretical": false,
"updated_at": "2021-11-28T01:35:50.930000Z",
"spacegroup": 206
},
{
"id": "mp-1079020",
"created_at": "2022-09-04T14:47:15.836084Z",
"structure_string": "Ge8\n1.0\n3.007580 -4.433182 0.000000\n3.007580 4.433182 0.000000\n0.000000 0.000000 5.882045\nGe\n8\ndirect\n0.717993 0.282007 0.500000 Ge\n0.217993 0.782007 0.000000 Ge\n0.282007 0.717993 0.500000 Ge\n0.782007 0.217993 0.000000 Ge\n0.331168 0.331168 0.829096 Ge\n0.668832 0.668832 0.170904 Ge\n0.168832 0.168832 0.329096 Ge\n0.831168 0.831168 0.670904 Ge\n",
"nsites": 8,
"nelements": 1,
"elements": [
"Ge"
],
"chemical_system": "Ge",
"density": 6.152106319155599,
"density_atomic": 0.05100337312395896,
"volume": 156.8523709315606,
"volume_molar": 11.807338203619878,
"formula_full": "Ge8",
"formula_reduced": "Ge",
"formula_anonymous": "A",
"energy": -34.47429677,
"energy_per_atom": -4.30928709625,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -34.47429677,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0034514,
"is_theoretical": false,
"updated_at": "2021-11-28T01:38:04.026000Z",
"spacegroup": 64
},
{
"id": "mp-12093",
"created_at": "2022-09-04T14:46:18.225381Z",
"structure_string": "Ge1\n1.0\n0.000000 2.141902 2.141902\n2.141902 0.000000 2.141902\n2.141902 2.141902 0.000000\nGe\n1\ndirect\n0.000000 0.000000 0.000000 Ge\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Ge"
],
"chemical_system": "Ge",
"density": 6.137565617256281,
"density_atomic": 0.05088282500499262,
"volume": 19.652996858996726,
"volume_molar": 11.835311344071616,
"formula_full": "Ge1",
"formula_reduced": "Ge",
"formula_anonymous": "A",
"energy": -4.28899835,
"energy_per_atom": -4.28899835,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -4.28899835,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0087759,
"is_theoretical": false,
"updated_at": "2021-11-28T01:37:30.602000Z",
"spacegroup": 225
},
{
"id": "mp-78",
"created_at": "2022-09-04T14:44:12.306578Z",
"structure_string": "Ge2\n1.0\n-2.591030 2.591030 1.436914\n2.591030 -2.591030 1.436914\n2.591030 2.591030 -1.436914\nGe\n2\ndirect\n0.500000 0.500000 0.000000 Ge\n0.750000 0.250000 0.500000 Ge\n",
"nsites": 2,
"nelements": 1,
"elements": [
"Ge"
],
"chemical_system": "Ge",
"density": 6.252004446617142,
"density_atomic": 0.05183156776250761,
"volume": 38.58652335511065,
"volume_molar": 11.61867375417519,
"formula_full": "Ge2",
"formula_reduced": "Ge",
"formula_anonymous": "A",
"energy": -8.78085444,
"energy_per_atom": -4.39042722,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -8.78085444,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0003795,
"is_theoretical": false,
"updated_at": "2021-11-28T01:36:36.053000Z",
"spacegroup": 141
},
{
"id": "mp-1007760",
"created_at": "2022-09-04T14:44:12.756311Z",
"structure_string": "Ge4\n1.0\n2.024987 -3.507380 0.000000\n2.024987 3.507380 0.000000\n0.000000 0.000000 6.683957\nGe\n4\ndirect\n0.666667 0.333333 0.062942 Ge\n0.333333 0.666667 0.562942 Ge\n0.666667 0.333333 0.437058 Ge\n0.333333 0.666667 0.937058 Ge\n",
"nsites": 4,
"nelements": 1,
"elements": [
"Ge"
],
"chemical_system": "Ge",
"density": 5.081784224344132,
"density_atomic": 0.04212998337214152,
"volume": 94.94425774316832,
"volume_molar": 14.294192112076988,
"formula_full": "Ge4",
"formula_reduced": "Ge",
"formula_anonymous": "A",
"energy": -18.40512385,
"energy_per_atom": -4.6012809625,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -18.40512385,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 8.1e-06,
"is_theoretical": false,
"updated_at": "2021-11-28T01:36:30.730000Z",
"spacegroup": 194
},
{
"id": "mp-998883",
"created_at": "2022-09-04T14:46:38.095288Z",
"structure_string": "Ge1\n1.0\n-1.696005 1.696005 1.696005\n1.696005 -1.696005 1.696005\n1.696005 1.696005 -1.696005\nGe\n1\ndirect\n0.000000 0.000000 0.000000 Ge\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Ge"
],
"chemical_system": "Ge",
"density": 6.181353159225227,
"density_atomic": 0.05124584089343222,
"volume": 19.5137787294688,
"volume_molar": 11.75147222683551,
"formula_full": "Ge1",
"formula_reduced": "Ge",
"formula_anonymous": "A",
"energy": -4.28353805,
"energy_per_atom": -4.28353805,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -4.28353805,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 2.72e-05,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:40.813000Z",
"spacegroup": 229
},
{
"id": "mp-1067619",
"created_at": "2022-09-04T14:41:47.039466Z",
"structure_string": "Ge4\n1.0\n2.025202 -3.507754 0.000000\n2.025202 3.507754 0.000000\n0.000000 0.000000 10.993359\nGe\n4\ndirect\n0.000000 0.000000 0.477452 Ge\n0.000000 0.000000 0.977452 Ge\n0.666667 0.333333 0.414848 Ge\n0.333333 0.666667 0.914848 Ge\n",
"nsites": 4,
"nelements": 1,
"elements": [
"Ge"
],
"chemical_system": "Ge",
"density": 3.0890649653867857,
"density_atomic": 0.025609559533001754,
"volume": 156.1916750206266,
"volume_molar": 23.515206312859736,
"formula_full": "Ge4",
"formula_reduced": "Ge",
"formula_anonymous": "A",
"energy": -16.58752852,
"energy_per_atom": -4.14688213,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -16.58752852,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 6.4e-06,
"is_theoretical": false,
"updated_at": "2021-11-28T01:35:39.733000Z",
"spacegroup": 186
},
{
"id": "mp-148",
"created_at": "2022-09-04T14:40:37.197396Z",
"structure_string": "Ge4\n1.0\n0.000000 2.885740 5.115665\n2.630497 0.000000 5.115665\n2.630497 2.885740 0.000000\nGe\n4\ndirect\n0.781867 0.781867 0.218133 Ge\n0.218133 0.218133 0.781867 Ge\n0.273510 0.726490 0.273510 Ge\n0.726490 0.273510 0.726490 Ge\n",
"nsites": 4,
"nelements": 1,
"elements": [
"Ge"
],
"chemical_system": "Ge",
"density": 6.212377263000351,
"density_atomic": 0.051503042875743914,
"volume": 77.66531406018841,
"volume_molar": 11.692786336001543,
"formula_full": "Ge4",
"formula_reduced": "Ge",
"formula_anonymous": "A",
"energy": -17.51967344,
"energy_per_atom": -4.37991836,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -17.51967344,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0033783,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:00.422000Z",
"spacegroup": 69
}
]
}