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=nsites&page=57",
"previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=nsites&page=55",
"results": [
{
"id": "mp-2636",
"created_at": "2022-09-04T14:41:26.246727Z",
"structure_string": "Gd1 Mg1\n1.0\n3.826877 0.000000 0.000000\n0.000000 3.826877 0.000000\n0.000000 0.000000 3.826877\nGd Mg\n1 1\ndirect\n0.500000 0.500000 0.500000 Gd\n0.000000 0.000000 0.000000 Mg\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Gd",
"Mg"
],
"chemical_system": "Gd-Mg",
"density": 5.379275658068197,
"density_atomic": 0.03568588605207595,
"volume": 56.04456610889319,
"volume_molar": 16.875413297044012,
"formula_full": "Gd1 Mg1",
"formula_reduced": "GdMg",
"formula_anonymous": "AB",
"energy": -15.8888235,
"energy_per_atom": -7.94441175,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -15.8888235,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 7.568202,
"is_theoretical": false,
"updated_at": "2021-11-28T01:35:21.561000Z",
"spacegroup": 221
},
{
"id": "mp-7592",
"created_at": "2022-09-04T14:41:23.132941Z",
"structure_string": "Ag1 F1\n1.0\n0.000000 2.514648 2.514648\n2.514648 0.000000 2.514648\n2.514648 2.514648 0.000000\nAg F\n1 1\ndirect\n0.000000 0.000000 0.000000 Ag\n0.500000 0.500000 0.500000 F\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Ag",
"F"
],
"chemical_system": "Ag-F",
"density": 6.624220955833901,
"density_atomic": 0.06288808879397713,
"volume": 31.802524744424137,
"volume_molar": 9.57596402671526,
"formula_full": "Ag1 F1",
"formula_reduced": "AgF",
"formula_anonymous": "AB",
"energy": -7.212117689999999,
"energy_per_atom": -3.6060588449999993,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -6.75011769,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0011883,
"is_theoretical": false,
"updated_at": "2021-11-28T01:35:19.210000Z",
"spacegroup": 225
},
{
"id": "mp-866199",
"created_at": "2022-09-04T14:42:14.301274Z",
"structure_string": "Ac1 Ag1\n1.0\n3.974166 0.000000 0.000000\n0.000000 3.974166 0.000000\n0.000000 0.000000 3.974166\nAc Ag\n1 1\ndirect\n0.000000 0.000000 0.000000 Ac\n0.500000 0.500000 0.500000 Ag\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Ac",
"Ag"
],
"chemical_system": "Ac-Ag",
"density": 8.859005974476117,
"density_atomic": 0.03186339042668897,
"volume": 62.7679595051752,
"volume_molar": 18.899874367907252,
"formula_full": "Ac1 Ag1",
"formula_reduced": "AcAg",
"formula_anonymous": "AB",
"energy": -7.46194633,
"energy_per_atom": -3.730973165,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -7.46194633,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.001207,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:40.122000Z",
"spacegroup": 221
},
{
"id": "mp-23245",
"created_at": "2022-09-04T14:42:14.218312Z",
"structure_string": "Er1 Bi1\n1.0\n0.000000 3.145294 3.145294\n3.145294 0.000000 3.145294\n3.145294 3.145294 0.000000\nEr Bi\n1 1\ndirect\n0.500000 0.500000 0.500000 Er\n0.000000 0.000000 0.000000 Bi\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Er",
"Bi"
],
"chemical_system": "Bi-Er",
"density": 10.039212233795395,
"density_atomic": 0.03213780864647495,
"volume": 62.23199664919814,
"volume_molar": 18.738492179865975,
"formula_full": "Er1 Bi1",
"formula_reduced": "ErBi",
"formula_anonymous": "AB",
"energy": -10.06444925,
"energy_per_atom": -5.032224625,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -10.06444925,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0016819,
"is_theoretical": false,
"updated_at": "2021-11-28T01:35:41.339000Z",
"spacegroup": 225
},
{
"id": "mp-1057437",
"created_at": "2022-09-04T14:41:45.492930Z",
"structure_string": "Rb1 S1\n1.0\n0.000000 3.402904 3.402904\n3.402904 0.000000 3.402904\n3.402904 3.402904 0.000000\nRb S\n1 1\ndirect\n0.000000 0.000000 0.000000 Rb\n0.500000 0.500000 0.500000 S\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Rb",
"S"
],
"chemical_system": "Rb-S",
"density": 2.476447311469058,
"density_atomic": 0.025377621054793253,
"volume": 78.80959352658651,
"volume_molar": 23.730123272774442,
"formula_full": "Rb1 S1",
"formula_reduced": "RbS",
"formula_anonymous": "AB",
"energy": -6.25514983,
"energy_per_atom": -3.127574915,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -5.75214983,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 0.9999783,
"is_theoretical": false,
"updated_at": "2021-11-28T01:35:21.682000Z",
"spacegroup": 225
},
{
"id": "mp-1009639",
"created_at": "2022-09-04T14:46:17.053168Z",
"structure_string": "Pr1 N1\n1.0\n0.000000 2.782711 2.782711\n2.782711 0.000000 2.782711\n2.782711 2.782711 0.000000\nPr N\n1 1\ndirect\n0.000000 0.000000 0.000000 Pr\n0.250000 0.250000 0.250000 N\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Pr",
"N"
],
"chemical_system": "N-Pr",
"density": 5.969066764996172,
"density_atomic": 0.04640830275189762,
"volume": 43.09573678425938,
"volume_molar": 12.976429653535988,
"formula_full": "Pr1 N1",
"formula_reduced": "PrN",
"formula_anonymous": "AB",
"energy": -15.8073047,
"energy_per_atom": -7.90365235,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -15.4463047,
"band_gap": 1.5598,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 6.7e-05,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:29.126000Z",
"spacegroup": 216
},
{
"id": "mp-22903",
"created_at": "2022-09-04T14:42:14.359237Z",
"structure_string": "Rb1 I1\n1.0\n0.000000 3.743926 3.743926\n3.743926 0.000000 3.743926\n3.743926 3.743926 0.000000\nRb I\n1 1\ndirect\n0.000000 0.000000 0.000000 Rb\n0.500000 0.500000 0.500000 I\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Rb",
"I"
],
"chemical_system": "I-Rb",
"density": 3.3599680093693327,
"density_atomic": 0.01905540710047656,
"volume": 104.95708590502805,
"volume_molar": 31.60331725397455,
"formula_full": "Rb1 I1",
"formula_reduced": "RbI",
"formula_anonymous": "AB",
"energy": -5.89620219,
"energy_per_atom": -2.948101095,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -5.51720219,
"band_gap": 3.7765,
"is_gap_direct": true,
"is_magnetic": false,
"total_magnetization": 0.0,
"is_theoretical": false,
"updated_at": "2021-11-28T01:35:45.067000Z",
"spacegroup": 225
},
{
"id": "mp-1009663",
"created_at": "2022-09-04T14:41:18.156349Z",
"structure_string": "Re1 C1\n1.0\n0.000000 2.324745 2.324745\n2.324745 0.000000 2.324745\n2.324745 2.324745 0.000000\nRe C\n1 1\ndirect\n0.000000 0.000000 0.000000 Re\n0.250000 0.250000 0.250000 C\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Re",
"C"
],
"chemical_system": "C-Re",
"density": 13.09892234175641,
"density_atomic": 0.0795928458191437,
"volume": 25.12788655081559,
"volume_molar": 7.566183490516118,
"formula_full": "Re1 C1",
"formula_reduced": "ReC",
"formula_anonymous": "AB",
"energy": -20.17800002,
"energy_per_atom": -10.08900001,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -20.17800002,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 0.7696709,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:14.274000Z",
"spacegroup": 216
},
{
"id": "mp-11374",
"created_at": "2022-09-04T14:42:10.410082Z",
"structure_string": "Dy1 Tl1\n1.0\n3.802627 0.000000 0.000000\n0.000000 3.802627 0.000000\n0.000000 0.000000 3.802627\nDy Tl\n1 1\ndirect\n0.000000 0.000000 0.000000 Dy\n0.500000 0.500000 0.500000 Tl\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Dy",
"Tl"
],
"chemical_system": "Dy-Tl",
"density": 11.079645335598276,
"density_atomic": 0.03637297407917361,
"volume": 54.98588033099987,
"volume_molar": 16.55663555828983,
"formula_full": "Dy1 Tl1",
"formula_reduced": "DyTl",
"formula_anonymous": "AB",
"energy": -7.63249834,
"energy_per_atom": -3.81624917,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -7.63249834,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0003285,
"is_theoretical": false,
"updated_at": "2021-11-28T01:35:40.089000Z",
"spacegroup": 221
},
{
"id": "mp-1217467",
"created_at": "2022-09-04T14:42:14.899269Z",
"structure_string": "Tb1 Lu1\n1.0\n1.781036 -3.084844 0.000000\n1.781036 3.084844 0.000000\n0.000000 0.000000 5.667818\nTb Lu\n1 1\ndirect\n0.000000 0.000000 0.500000 Tb\n0.333333 0.666667 0.000000 Lu\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Tb",
"Lu"
],
"chemical_system": "Lu-Tb",
"density": 8.902331655036518,
"density_atomic": 0.03211280182811048,
"volume": 62.280457828169524,
"volume_molar": 18.753084181924038,
"formula_full": "Tb1 Lu1",
"formula_reduced": "TbLu",
"formula_anonymous": "AB",
"energy": -9.12441844,
"energy_per_atom": -4.56220922,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -9.12441844,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 0.3623358,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:36.864000Z",
"spacegroup": 187
},
{
"id": "mp-1087",
"created_at": "2022-09-04T14:41:45.626627Z",
"structure_string": "Sr1 S1\n1.0\n0.000000 3.031729 3.031729\n3.031729 0.000000 3.031729\n3.031729 3.031729 0.000000\nSr S\n1 1\ndirect\n0.000000 0.000000 0.000000 Sr\n0.500000 0.500000 0.500000 S\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Sr",
"S"
],
"chemical_system": "S-Sr",
"density": 3.566052165542995,
"density_atomic": 0.03588631508680976,
"volume": 55.731551014974855,
"volume_molar": 16.781162249264973,
"formula_full": "Sr1 S1",
"formula_reduced": "SrS",
"formula_anonymous": "AB",
"energy": -10.61606558,
"energy_per_atom": -5.30803279,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -10.11306558,
"band_gap": 2.497,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0,
"is_theoretical": false,
"updated_at": "2021-11-28T01:35:25.823000Z",
"spacegroup": 225
},
{
"id": "mp-1183965",
"created_at": "2022-09-04T14:42:18.389362Z",
"structure_string": "Cs1 Eu1\n1.0\n2.232210 -3.866301 0.000000\n2.232210 3.866301 0.000000\n0.000000 0.000000 8.008631\nCs Eu\n1 1\ndirect\n0.333333 0.666667 0.500000 Cs\n0.000000 0.000000 0.000000 Eu\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Cs",
"Eu"
],
"chemical_system": "Cs-Eu",
"density": 3.4219683367933813,
"density_atomic": 0.014468083446720998,
"volume": 138.2353099748864,
"volume_molar": 41.623624733549896,
"formula_full": "Cs1 Eu1",
"formula_reduced": "CsEu",
"formula_anonymous": "AB",
"energy": -10.55387,
"energy_per_atom": -5.276935,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -10.55387,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 7.705775,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:41.741000Z",
"spacegroup": 187
}
]
}