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=12175",
"previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=-elements&page=12173",
"results": [
{
"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-1224349",
"created_at": "2022-09-04T14:44:50.483390Z",
"structure_string": "Ge1\n1.0\n1.397149 -2.600516 0.000000\n1.397149 2.600516 0.000000\n0.000000 0.000000 2.698231\nGe\n1\ndirect\n0.500000 0.500000 0.000000 Ge\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Ge"
],
"chemical_system": "Ge",
"density": 6.151960740616385,
"density_atomic": 0.05100216622079943,
"volume": 19.607010331106004,
"volume_molar": 11.807617609669457,
"formula_full": "Ge1",
"formula_reduced": "Ge",
"formula_anonymous": "A",
"energy": -4.37127396,
"energy_per_atom": -4.37127396,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -4.37127396,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0012313,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:45.818000Z",
"spacegroup": 65
},
{
"id": "mp-32",
"created_at": "2022-09-04T14:40:25.796908Z",
"structure_string": "Ge2\n1.0\n0.000000 2.881431 2.881431\n2.881431 0.000000 2.881431\n2.881431 2.881431 0.000000\nGe\n2\ndirect\n0.500000 0.500000 0.500000 Ge\n0.750000 0.750000 0.750000 Ge\n",
"nsites": 2,
"nelements": 1,
"elements": [
"Ge"
],
"chemical_system": "Ge",
"density": 5.041970034757574,
"density_atomic": 0.04179990813257869,
"volume": 47.84699510957077,
"volume_molar": 14.407066974643339,
"formula_full": "Ge2",
"formula_reduced": "Ge",
"formula_anonymous": "A",
"energy": -9.24605571,
"energy_per_atom": -4.623027855,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -9.24605571,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0002151,
"is_theoretical": false,
"updated_at": "2021-11-28T01:34:50.335000Z",
"spacegroup": 227
},
{
"id": "mp-1008733",
"created_at": "2022-09-04T14:47:24.181157Z",
"structure_string": "Ge2\n1.0\n1.495562 -2.590389 0.000000\n1.495562 2.590389 0.000000\n0.000000 0.000000 5.003386\nGe\n2\ndirect\n0.333333 0.666667 0.250000 Ge\n0.666667 0.333333 0.750000 Ge\n",
"nsites": 2,
"nelements": 1,
"elements": [
"Ge"
],
"chemical_system": "Ge",
"density": 6.222881270134663,
"density_atomic": 0.051590125212650204,
"volume": 38.7671088557387,
"volume_molar": 11.67304931937505,
"formula_full": "Ge2",
"formula_reduced": "Ge",
"formula_anonymous": "A",
"energy": -8.58374841,
"energy_per_atom": -4.291874205,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -8.58374841,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0016113,
"is_theoretical": false,
"updated_at": "2021-11-28T01:38:00.048000Z",
"spacegroup": 194
},
{
"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-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-570087",
"created_at": "2022-09-04T14:46:30.472046Z",
"structure_string": "Gd3\n1.0\n8.740421 -1.811792 0.000000\n8.740421 1.811792 0.000000\n8.364856 0.000000 3.115562\nGd\n3\ndirect\n0.000000 0.000000 0.000000 Gd\n0.777870 0.777870 0.777870 Gd\n0.222130 0.222130 0.222130 Gd\n",
"nsites": 3,
"nelements": 1,
"elements": [
"Gd"
],
"chemical_system": "Gd",
"density": 7.938782852451279,
"density_atomic": 0.03040284121911447,
"volume": 98.67498824793651,
"volume_molar": 19.807822290680644,
"formula_full": "Gd3",
"formula_reduced": "Gd",
"formula_anonymous": "A",
"energy": -42.16745012,
"energy_per_atom": -14.055816706666667,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -42.16745012,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 22.5160219,
"is_theoretical": false,
"updated_at": "2021-11-28T01:37:32.261000Z",
"spacegroup": 166
},
{
"id": "mp-155",
"created_at": "2022-09-04T14:40:16.860170Z",
"structure_string": "Gd2\n1.0\n1.806967 -3.129758 0.000000\n1.806967 3.129758 0.000000\n0.000000 0.000000 5.770074\nGd\n2\ndirect\n0.333333 0.666667 0.250000 Gd\n0.666667 0.333333 0.750000 Gd\n",
"nsites": 2,
"nelements": 1,
"elements": [
"Gd"
],
"chemical_system": "Gd",
"density": 8.001978666054116,
"density_atomic": 0.03064485971519747,
"volume": 65.26380014747319,
"volume_molar": 19.651389551029613,
"formula_full": "Gd2",
"formula_reduced": "Gd",
"formula_anonymous": "A",
"energy": -28.15224448,
"energy_per_atom": -14.07612224,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -28.15224448,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 15.303261,
"is_theoretical": false,
"updated_at": "2021-11-28T01:34:53.854000Z",
"spacegroup": 194
},
{
"id": "mp-614502",
"created_at": "2022-09-04T14:45:16.611696Z",
"structure_string": "Gd1\n1.0\n0.000000 2.521600 2.521600\n2.521600 0.000000 2.521600\n2.521600 2.521600 0.000000\nGd\n1\ndirect\n0.000000 0.000000 0.000000 Gd\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Gd"
],
"chemical_system": "Gd",
"density": 8.14293875720926,
"density_atomic": 0.031184688974829945,
"volume": 32.067018555391996,
"volume_molar": 19.311209949410244,
"formula_full": "Gd1",
"formula_reduced": "Gd",
"formula_anonymous": "A",
"energy": -14.02770758,
"energy_per_atom": -14.02770758,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -14.02770758,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 7.4492425,
"is_theoretical": false,
"updated_at": "2021-11-28T01:36:53.128000Z",
"spacegroup": 225
},
{
"id": "mp-19981",
"created_at": "2022-09-04T14:47:07.532389Z",
"structure_string": "Gd4\n1.0\n1.806374 -3.128731 0.000000\n1.806374 3.128731 0.000000\n0.000000 0.000000 11.644222\nGd\n4\ndirect\n0.000000 0.000000 0.000000 Gd\n0.000000 0.000000 0.500000 Gd\n0.333333 0.666667 0.250000 Gd\n0.666667 0.333333 0.750000 Gd\n",
"nsites": 4,
"nelements": 1,
"elements": [
"Gd"
],
"chemical_system": "Gd",
"density": 7.935665832686046,
"density_atomic": 0.03039090409238351,
"volume": 131.61832855780258,
"volume_molar": 19.81560252927537,
"formula_full": "Gd4",
"formula_reduced": "Gd",
"formula_anonymous": "A",
"energy": -56.18320903,
"energy_per_atom": -14.0458022575,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -56.18320903,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 29.7454656,
"is_theoretical": false,
"updated_at": "2021-11-28T01:37:57.674000Z",
"spacegroup": 194
},
{
"id": "mp-11421",
"created_at": "2022-09-04T14:45:16.036298Z",
"structure_string": "Gd1\n1.0\n-2.018432 2.018432 2.018432\n2.018432 -2.018432 2.018432\n2.018432 2.018432 -2.018432\nGd\n1\ndirect\n0.000000 0.000000 0.000000 Gd\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Gd"
],
"chemical_system": "Gd",
"density": 7.938480673033082,
"density_atomic": 0.030401683974604583,
"volume": 32.89291477522526,
"volume_molar": 19.808576278309026,
"formula_full": "Gd1",
"formula_reduced": "Gd",
"formula_anonymous": "A",
"energy": -13.98852267,
"energy_per_atom": -13.98852267,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -13.98852267,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 7.6239299,
"is_theoretical": false,
"updated_at": "2021-11-28T01:37:05.046000Z",
"spacegroup": 229
},
{
"id": "mp-569423",
"created_at": "2022-09-04T14:44:25.283106Z",
"structure_string": "Ga6\n1.0\n-3.044339 3.044339 3.044339\n3.044339 -3.044339 3.044339\n3.044339 3.044339 -3.044339\nGa\n6\ndirect\n0.750000 0.875000 0.125000 Ga\n0.375000 0.250000 0.625000 Ga\n0.250000 0.625000 0.375000 Ga\n0.875000 0.125000 0.750000 Ga\n0.625000 0.375000 0.250000 Ga\n0.125000 0.750000 0.875000 Ga\n",
"nsites": 6,
"nelements": 1,
"elements": [
"Ga"
],
"chemical_system": "Ga",
"density": 6.155132240124962,
"density_atomic": 0.05316333599996591,
"volume": 112.85973476163812,
"volume_molar": 11.327620147847496,
"formula_full": "Ga6",
"formula_reduced": "Ga",
"formula_anonymous": "A",
"energy": -18.10051829,
"energy_per_atom": -3.0167530483333334,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -18.10051829,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0009317,
"is_theoretical": false,
"updated_at": "2021-11-28T01:36:38.156000Z",
"spacegroup": 220
}
]
}