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=formula_full&page=12",
"previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=formula_full&page=10",
"results": [
{
"id": "mp-1232311",
"created_at": "2022-09-04T14:43:20.707022Z",
"structure_string": "Ac2 Cu2 O4 F2\n1.0\n-2.823761 2.823761 4.088983\n2.823761 -2.823761 4.088983\n2.823761 2.823761 -4.088983\nAc Cu O F\n2 2 4 2\ndirect\n0.250000 0.750000 0.500000 Ac\n0.750000 0.250000 0.500000 Ac\n0.000000 0.000000 0.000000 Cu\n0.500000 0.500000 0.000000 Cu\n0.295408 0.795408 0.090815 O\n0.795408 0.704592 0.500000 O\n0.704592 0.204592 0.909185 O\n0.204592 0.295408 0.500000 O\n0.250000 0.250000 0.000000 F\n0.750000 0.750000 0.000000 F\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Ac",
"Cu",
"O",
"F"
],
"chemical_system": "Ac-Cu-F-O",
"density": 8.69748267941945,
"density_atomic": 0.0766776567071009,
"volume": 130.4160876772585,
"volume_molar": 7.853840373609523,
"formula_full": "Ac2 Cu2 O4 F2",
"formula_reduced": "AcCuO2F",
"formula_anonymous": "ABCD2",
"energy": -66.40930369,
"energy_per_atom": -6.640930369,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -62.73730369,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0021544,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:09.904000Z",
"spacegroup": 140
},
{
"id": "mp-1183114",
"created_at": "2022-09-04T14:43:57.605058Z",
"structure_string": "Ac2 Cu6\n1.0\n3.332061 -5.771298 0.000000\n3.332061 5.771298 0.000000\n0.000000 0.000000 4.270502\nAc Cu\n2 6\ndirect\n0.333333 0.666667 0.750000 Ac\n0.666667 0.333333 0.250000 Ac\n0.125691 0.251383 0.250000 Cu\n0.748617 0.874309 0.250000 Cu\n0.125691 0.874309 0.250000 Cu\n0.874309 0.748617 0.750000 Cu\n0.251383 0.125691 0.750000 Cu\n0.874309 0.125691 0.750000 Cu\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Ac",
"Cu"
],
"chemical_system": "Ac-Cu",
"density": 8.44469040199789,
"density_atomic": 0.04870736311640868,
"volume": 164.24621429167323,
"volume_molar": 12.36392277201975,
"formula_full": "Ac2 Cu6",
"formula_reduced": "AcCu3",
"formula_anonymous": "AB3",
"energy": -33.4664146,
"energy_per_atom": -4.183301825,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -33.4664146,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0102553,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:12.903000Z",
"spacegroup": 194
},
{
"id": "mp-1183125",
"created_at": "2022-09-04T14:41:46.701817Z",
"structure_string": "Ac2 Eu6\n1.0\n3.999956 -6.928127 0.000000\n3.999956 6.928127 0.000000\n0.000000 0.000000 6.441200\nAc Eu\n2 6\ndirect\n0.333333 0.666667 0.750000 Ac\n0.666667 0.333333 0.250000 Ac\n0.167419 0.334838 0.250000 Eu\n0.665162 0.832581 0.250000 Eu\n0.167419 0.832581 0.250000 Eu\n0.832581 0.665162 0.750000 Eu\n0.334838 0.167419 0.750000 Eu\n0.832581 0.167419 0.750000 Eu\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Ac",
"Eu"
],
"chemical_system": "Ac-Eu",
"density": 6.352772221804174,
"density_atomic": 0.02240898329407495,
"volume": 356.99968601945636,
"volume_molar": 26.87377950606213,
"formula_full": "Ac2 Eu6",
"formula_reduced": "AcEu3",
"formula_anonymous": "AB3",
"energy": -69.58062973,
"energy_per_atom": -8.69757871625,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -69.58062973,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 45.39397,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:24.011000Z",
"spacegroup": 194
},
{
"id": "mp-862683",
"created_at": "2022-09-04T14:44:44.455070Z",
"structure_string": "Ac2 Ga1 Cu1\n1.0\n0.000000 3.831425 3.831425\n3.831425 0.000000 3.831425\n3.831425 3.831425 0.000000\nAc Ga Cu\n2 1 1\ndirect\n0.750000 0.750000 0.750000 Ac\n0.250000 0.250000 0.250000 Ac\n0.000000 0.000000 0.000000 Ga\n0.500000 0.500000 0.500000 Cu\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ac",
"Ga",
"Cu"
],
"chemical_system": "Ac-Cu-Ga",
"density": 8.669123545898811,
"density_atomic": 0.035558956646630065,
"volume": 112.48923976454977,
"volume_molar": 16.9356508961877,
"formula_full": "Ac2 Ga1 Cu1",
"formula_reduced": "Ac2GaCu",
"formula_anonymous": "ABC2",
"energy": -16.40123261,
"energy_per_atom": -4.1003081525,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -16.40123261,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 8.1e-05,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:46.173000Z",
"spacegroup": 225
},
{
"id": "mp-1183054",
"created_at": "2022-09-04T14:47:56.452882Z",
"structure_string": "Ac2 Ga1 Si1\n1.0\n0.000000 3.888966 3.888966\n3.888966 0.000000 3.888966\n3.888966 3.888966 0.000000\nAc Ga Si\n2 1 1\ndirect\n0.750000 0.750000 0.750000 Ac\n0.250000 0.250000 0.250000 Ac\n0.500000 0.500000 0.500000 Ga\n0.000000 0.000000 0.000000 Si\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ac",
"Ga",
"Si"
],
"chemical_system": "Ac-Ga-Si",
"density": 7.7894187033594156,
"density_atomic": 0.034003808122867143,
"volume": 117.63388340349002,
"volume_molar": 17.71019510003112,
"formula_full": "Ac2 Ga1 Si1",
"formula_reduced": "Ac2GaSi",
"formula_anonymous": "ABC2",
"energy": -18.07300591,
"energy_per_atom": -4.5182514775,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -18.14400591,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.000523,
"is_theoretical": true,
"updated_at": "2021-11-28T01:38:22.346000Z",
"spacegroup": 225
},
{
"id": "mp-867815",
"created_at": "2022-09-04T14:43:59.786173Z",
"structure_string": "Ac2 Ga6\n1.0\n3.420561 -5.924586 0.000000\n3.420561 5.924586 0.000000\n0.000000 0.000000 4.704987\nAc Ga\n2 6\ndirect\n0.333333 0.666667 0.750000 Ac\n0.666667 0.333333 0.250000 Ac\n0.135606 0.271211 0.250000 Ga\n0.728789 0.864394 0.250000 Ga\n0.135606 0.864394 0.250000 Ga\n0.864394 0.728789 0.750000 Ga\n0.271211 0.135606 0.750000 Ga\n0.864394 0.135606 0.750000 Ga\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Ac",
"Ga"
],
"chemical_system": "Ac-Ga",
"density": 7.596090276375485,
"density_atomic": 0.041951376540569255,
"volume": 190.69696061733674,
"volume_molar": 14.35504924177223,
"formula_full": "Ac2 Ga6",
"formula_reduced": "AcGa3",
"formula_anonymous": "AB3",
"energy": -30.66552448,
"energy_per_atom": -3.83319056,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -30.66552448,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0005709,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:07.355000Z",
"spacegroup": 194
},
{
"id": "mp-867241",
"created_at": "2022-09-04T14:46:28.223108Z",
"structure_string": "Ac2 Ge1 Pd1\n1.0\n0.000000 3.863814 3.863814\n3.863814 0.000000 3.863814\n3.863814 3.863814 0.000000\nAc Ge Pd\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Ac\n0.750000 0.750000 0.750000 Ac\n0.000000 0.000000 0.000000 Ge\n0.500000 0.500000 0.500000 Pd\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ac",
"Ge",
"Pd"
],
"chemical_system": "Ac-Ge-Pd",
"density": 9.112034175603862,
"density_atomic": 0.034672196906694645,
"volume": 115.36621145652481,
"volume_molar": 17.368789108477923,
"formula_full": "Ac2 Ge1 Pd1",
"formula_reduced": "Ac2GePd",
"formula_anonymous": "ABC2",
"energy": -20.70608788,
"energy_per_atom": -5.17652197,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -20.70608788,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 1.09e-05,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:41.930000Z",
"spacegroup": 225
},
{
"id": "mp-862665",
"created_at": "2022-09-04T14:40:35.036701Z",
"structure_string": "Ac2 Ge6\n1.0\n3.322268 -5.754336 0.000000\n3.322268 5.754336 0.000000\n0.000000 0.000000 4.968041\nAc Ge\n2 6\ndirect\n0.333333 0.666667 0.750000 Ac\n0.666667 0.333333 0.250000 Ac\n0.136989 0.273977 0.250000 Ge\n0.726023 0.863011 0.250000 Ge\n0.136989 0.863011 0.250000 Ge\n0.863011 0.726023 0.750000 Ge\n0.273977 0.136989 0.750000 Ge\n0.863011 0.136989 0.750000 Ge\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Ac",
"Ge"
],
"chemical_system": "Ac-Ge",
"density": 7.778860343599504,
"density_atomic": 0.042115788867865635,
"volume": 189.952514604422,
"volume_molar": 14.299009758297313,
"formula_full": "Ac2 Ge6",
"formula_reduced": "AcGe3",
"formula_anonymous": "AB3",
"energy": -39.5011003,
"energy_per_atom": -4.9376375375,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -39.5011003,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0017364,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:52.278000Z",
"spacegroup": 194
},
{
"id": "mp-861872",
"created_at": "2022-09-04T14:47:46.282690Z",
"structure_string": "Ac2 Hg1 Ge1\n1.0\n0.000000 3.976132 3.976132\n3.976132 0.000000 3.976132\n3.976132 3.976132 0.000000\nAc Hg Ge\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Ac\n0.750000 0.750000 0.750000 Ac\n0.000000 0.000000 0.000000 Hg\n0.500000 0.500000 0.500000 Ge\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ac",
"Hg",
"Ge"
],
"chemical_system": "Ac-Ge-Hg",
"density": 9.605246329241522,
"density_atomic": 0.03181614919580075,
"volume": 125.72231715986356,
"volume_molar": 18.927937265251547,
"formula_full": "Ac2 Hg1 Ge1",
"formula_reduced": "Ac2HgGe",
"formula_anonymous": "ABC2",
"energy": -15.14009427,
"energy_per_atom": -3.7850235675,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -15.14009427,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0029286,
"is_theoretical": true,
"updated_at": "2021-11-28T01:38:21.543000Z",
"spacegroup": 225
},
{
"id": "mp-862289",
"created_at": "2022-09-04T14:43:09.338290Z",
"structure_string": "Ac2 Hg6\n1.0\n3.571108 -6.185341 0.000000\n3.571108 6.185341 0.000000\n0.000000 0.000000 5.209057\nAc Hg\n2 6\ndirect\n0.333333 0.666667 0.750000 Ac\n0.666667 0.333333 0.250000 Ac\n0.157671 0.315342 0.250000 Hg\n0.684658 0.842329 0.250000 Hg\n0.157671 0.842329 0.250000 Hg\n0.842329 0.684658 0.750000 Hg\n0.315342 0.157671 0.750000 Hg\n0.842329 0.157671 0.750000 Hg\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Ac",
"Hg"
],
"chemical_system": "Ac-Hg",
"density": 11.960721487060978,
"density_atomic": 0.03476436087750737,
"volume": 230.12072703387508,
"volume_molar": 17.32274262489416,
"formula_full": "Ac2 Hg6",
"formula_reduced": "AcHg3",
"formula_anonymous": "AB3",
"energy": -13.39503475,
"energy_per_atom": -1.67437934375,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -13.39503475,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0010039,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:02.810000Z",
"spacegroup": 194
},
{
"id": "mp-861867",
"created_at": "2022-09-04T14:42:09.075695Z",
"structure_string": "Ac2 I6\n1.0\n5.797535 -10.041626 0.000000\n5.797535 10.041626 0.000000\n0.000000 0.000000 4.390259\nAc I\n2 6\ndirect\n0.333333 0.666667 0.750000 Ac\n0.666667 0.333333 0.250000 Ac\n0.211024 0.422049 0.250000 I\n0.577951 0.788976 0.250000 I\n0.211024 0.788976 0.250000 I\n0.788976 0.577951 0.750000 I\n0.422049 0.211024 0.750000 I\n0.788976 0.211024 0.750000 I\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Ac",
"I"
],
"chemical_system": "Ac-I",
"density": 3.9483019114656055,
"density_atomic": 0.015650291397742787,
"volume": 511.1725907642733,
"volume_molar": 38.47941617795412,
"formula_full": "Ac2 I6",
"formula_reduced": "AcI3",
"formula_anonymous": "AB3",
"energy": -31.79445133,
"energy_per_atom": -3.97430641625,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -29.52045133,
"band_gap": 2.5886,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0003982,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:38.744000Z",
"spacegroup": 194
},
{
"id": "mp-1183377",
"created_at": "2022-09-04T14:40:57.629474Z",
"structure_string": "Ac2 In1 Ga1\n1.0\n0.000000 4.039104 4.039104\n4.039104 0.000000 4.039104\n4.039104 4.039104 0.000000\nAc In Ga\n2 1 1\ndirect\n0.750000 0.750000 0.750000 Ac\n0.250000 0.250000 0.250000 Ac\n0.000000 0.000000 0.000000 In\n0.500000 0.500000 0.500000 Ga\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ac",
"In",
"Ga"
],
"chemical_system": "Ac-Ga-In",
"density": 8.045495252419967,
"density_atomic": 0.03035113166467208,
"volume": 131.7908025372212,
"volume_molar": 19.84156909381278,
"formula_full": "Ac2 In1 Ga1",
"formula_reduced": "Ac2InGa",
"formula_anonymous": "ABC2",
"energy": -15.60809668,
"energy_per_atom": -3.90202417,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -15.60809668,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0983653,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:21.172000Z",
"spacegroup": 225
}
]
}