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=volume_molar&page=12117",
"previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=volume_molar&page=12115",
"results": [
{
"id": "mp-1097424",
"created_at": "2022-09-04T14:46:25.142375Z",
"structure_string": "Y1 Zn2 Ag1\n1.0\n-5.736728 5.890208 8.199925\n5.736728 -5.890208 8.199925\n5.736728 5.890208 -8.199925\nY Zn Ag\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Y\n0.000000 0.275217 0.275217 Zn\n0.000000 0.724783 0.724783 Zn\n0.000000 0.500000 0.500000 Ag\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Y",
"Zn",
"Ag"
],
"chemical_system": "Ag-Y-Zn",
"density": 0.49081484491384736,
"density_atomic": 0.003609069370505426,
"volume": 1108.3189568727594,
"volume_molar": 166.86131913160315,
"formula_full": "Y1 Zn2 Ag1",
"formula_reduced": "YZn2Ag",
"formula_anonymous": "ABC2",
"energy": -5.64694633,
"energy_per_atom": -1.4117365825,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -5.64694633,
"band_gap": 0.3673000000000002,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 1.78e-05,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:36.109000Z",
"spacegroup": 71
},
{
"id": "mp-1096309",
"created_at": "2022-09-04T14:42:22.732407Z",
"structure_string": "Sc2 Hg1 Pd1\n1.0\n-5.411093 6.012537 8.517888\n5.411093 -6.012537 8.517888\n5.411093 6.012537 -8.517888\nSc Hg Pd\n2 1 1\ndirect\n0.000000 0.217039 0.217039 Sc\n0.000000 0.782961 0.782961 Sc\n0.000000 0.500000 0.500000 Hg\n0.000000 0.000000 0.000000 Pd\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sc",
"Hg",
"Pd"
],
"chemical_system": "Hg-Pd-Sc",
"density": 0.5945924620149997,
"density_atomic": 0.0036084884083639615,
"volume": 1108.4973948450465,
"volume_molar": 166.8881835962542,
"formula_full": "Sc2 Hg1 Pd1",
"formula_reduced": "Sc2HgPd",
"formula_anonymous": "ABC2",
"energy": -11.56451425,
"energy_per_atom": -2.8911285625,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -11.56451425,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 2.3662016,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:43.263000Z",
"spacegroup": 71
},
{
"id": "mp-1097282",
"created_at": "2022-09-04T14:39:40.260156Z",
"structure_string": "Li1 Cd1 Hg2\n1.0\n-5.757913 5.836900 8.247286\n5.757913 -5.836900 8.247286\n5.757913 5.836900 -8.247286\nLi Cd Hg\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Li\n0.000000 0.500000 0.500000 Cd\n0.000000 0.237947 0.237947 Hg\n0.000000 0.762053 0.762053 Hg\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Li",
"Cd",
"Hg"
],
"chemical_system": "Cd-Hg-Li",
"density": 0.779611312960708,
"density_atomic": 0.0036077928475945864,
"volume": 1108.7111064779976,
"volume_molar": 166.92035863464625,
"formula_full": "Li1 Cd1 Hg2",
"formula_reduced": "LiCdHg2",
"formula_anonymous": "ABC2",
"energy": -1.7696006,
"energy_per_atom": -0.44240015,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -1.7696006,
"band_gap": 0.0521,
"is_gap_direct": true,
"is_magnetic": false,
"total_magnetization": 0.0008699,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:40.454000Z",
"spacegroup": 71
},
{
"id": "mp-1093980",
"created_at": "2022-09-04T14:48:06.826402Z",
"structure_string": "Sc2 Ga1 Hg1\n1.0\n-5.749744 5.779442 8.346705\n5.749744 -5.779442 8.346705\n5.749744 5.779442 -8.346705\nSc Ga Hg\n2 1 1\ndirect\n0.000000 0.231699 0.231699 Sc\n0.000000 0.768301 0.768301 Sc\n0.000000 0.000000 0.000000 Ga\n0.000000 0.500000 0.500000 Hg\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sc",
"Ga",
"Hg"
],
"chemical_system": "Ga-Hg-Sc",
"density": 0.5391545333118021,
"density_atomic": 0.0036053756163321247,
"volume": 1109.4544440474529,
"volume_molar": 167.03227072153265,
"formula_full": "Sc2 Ga1 Hg1",
"formula_reduced": "Sc2GaHg",
"formula_anonymous": "ABC2",
"energy": -8.5343415,
"energy_per_atom": -2.133585375,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -8.5343415,
"band_gap": 0.1114999999999999,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 1.0065191,
"is_theoretical": true,
"updated_at": "2021-11-28T01:38:34.038000Z",
"spacegroup": 71
},
{
"id": "mp-1097580",
"created_at": "2022-09-04T14:47:19.195016Z",
"structure_string": "Li2 Tl1 Sb1\n1.0\n-5.634010 5.897992 8.347853\n5.634010 -5.897992 8.347853\n5.634010 5.897992 -8.347853\nLi Tl Sb\n2 1 1\ndirect\n0.000000 0.241484 0.241484 Li\n0.000000 0.758516 0.758516 Li\n0.000000 0.500000 0.500000 Tl\n0.000000 0.000000 0.000000 Sb\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Li",
"Tl",
"Sb"
],
"chemical_system": "Li-Sb-Tl",
"density": 0.5088663735075998,
"density_atomic": 0.003604984605971984,
"volume": 1109.574779701871,
"volume_molar": 167.05038767776648,
"formula_full": "Li2 Tl1 Sb1",
"formula_reduced": "Li2TlSb",
"formula_anonymous": "ABC2",
"energy": -7.05559538,
"energy_per_atom": -1.763898845,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -6.86359538,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 1.7367956,
"is_theoretical": true,
"updated_at": "2021-11-28T01:38:02.272000Z",
"spacegroup": 71
},
{
"id": "mp-1096123",
"created_at": "2022-09-04T14:40:30.240169Z",
"structure_string": "Hf1 Sc1 Au2\n1.0\n-5.264720 6.024192 8.750457\n5.264720 -6.024192 8.750457\n5.264720 6.024192 -8.750457\nHf Sc Au\n1 1 2\ndirect\n0.000000 0.500000 0.500000 Hf\n0.000000 0.000000 0.000000 Sc\n0.000000 0.249472 0.249472 Au\n0.000000 0.750528 0.750528 Au\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Hf",
"Sc",
"Au"
],
"chemical_system": "Au-Hf-Sc",
"density": 0.923498460342543,
"density_atomic": 0.003603256522389599,
"volume": 1110.1069199889464,
"volume_molar": 167.13050327058733,
"formula_full": "Hf1 Sc1 Au2",
"formula_reduced": "HfScAu2",
"formula_anonymous": "ABC2",
"energy": -14.50048847,
"energy_per_atom": -3.6251221175,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -14.50048847,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 3.0104851,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:06.976000Z",
"spacegroup": 71
},
{
"id": "mp-1097399",
"created_at": "2022-09-04T14:43:53.535547Z",
"structure_string": "Li1 In1 Hg2\n1.0\n-5.780514 5.799187 8.289156\n5.780514 -5.799187 8.289156\n5.780514 5.799187 -8.289156\nLi In Hg\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Li\n0.000000 0.500000 0.500000 In\n0.000000 0.233308 0.233308 Hg\n0.000000 0.766692 0.766692 Hg\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Li",
"In",
"Hg"
],
"chemical_system": "Hg-In-Li",
"density": 0.7812611968832194,
"density_atomic": 0.0035987867797832797,
"volume": 1111.4856880298091,
"volume_molar": 167.33808165102397,
"formula_full": "Li1 In1 Hg2",
"formula_reduced": "LiInHg2",
"formula_anonymous": "ABC2",
"energy": -2.75633532,
"energy_per_atom": -0.68908383,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -2.75633532,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.9500247,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:24.227000Z",
"spacegroup": 71
},
{
"id": "mp-1096145",
"created_at": "2022-09-04T14:45:15.652754Z",
"structure_string": "Y2 Zn1 Tc1\n1.0\n-5.534627 5.980866 8.395310\n5.534627 -5.980866 8.395310\n5.534627 5.980866 -8.395310\nY Zn Tc\n2 1 1\ndirect\n0.000000 0.291154 0.291154 Y\n0.000000 0.708846 0.708846 Y\n0.000000 0.000000 0.000000 Zn\n0.000000 0.500000 0.500000 Tc\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Y",
"Zn",
"Tc"
],
"chemical_system": "Tc-Y-Zn",
"density": 0.5097242655702863,
"density_atomic": 0.0035984115583992233,
"volume": 1111.60158727909,
"volume_molar": 167.35553069085265,
"formula_full": "Y2 Zn1 Tc1",
"formula_reduced": "Y2ZnTc",
"formula_anonymous": "ABC2",
"energy": -15.01310708,
"energy_per_atom": -3.75327677,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -15.01310708,
"band_gap": 0.0504999999999999,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0002191,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:55.709000Z",
"spacegroup": 71
},
{
"id": "mp-1181264",
"created_at": "2022-09-04T14:43:16.774732Z",
"structure_string": "Ge1 Te1\n1.0\n6.691573 7.305897 0.000000\n-6.691573 7.305897 0.000000\n0.000000 1.751909 5.685961\nGe Te\n1 1\ndirect\n0.006316 0.006316 0.972151 Ge\n0.951684 0.951684 0.632849 Te\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Ge",
"Te"
],
"chemical_system": "Ge-Te",
"density": 0.5980869089185615,
"density_atomic": 0.00359744661752454,
"volume": 555.9498757416536,
"volume_molar": 167.40042036103736,
"formula_full": "Ge1 Te1",
"formula_reduced": "GeTe",
"formula_anonymous": "AB",
"energy": -6.759738329999999,
"energy_per_atom": -3.3798691649999997,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -6.33773833,
"band_gap": 2.1769,
"is_gap_direct": true,
"is_magnetic": false,
"total_magnetization": 0.0,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:03.811000Z",
"spacegroup": 8
},
{
"id": "mp-1097652",
"created_at": "2022-09-04T14:40:11.359889Z",
"structure_string": "Mg1 Sc1 Cu2\n1.0\n-5.304264 6.084300 8.616609\n5.304264 -6.084300 8.616609\n5.304264 6.084300 -8.616609\nMg Sc Cu\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Mg\n0.000000 0.500000 0.500000 Sc\n0.000000 0.256473 0.256473 Cu\n0.000000 0.743527 0.743527 Cu\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Mg",
"Sc",
"Cu"
],
"chemical_system": "Cu-Mg-Sc",
"density": 0.293125982189967,
"density_atomic": 0.0035960677288478728,
"volume": 1112.3261021787098,
"volume_molar": 167.46460895855836,
"formula_full": "Mg1 Sc1 Cu2",
"formula_reduced": "MgScCu2",
"formula_anonymous": "ABC2",
"energy": -8.66387174,
"energy_per_atom": -2.165967935,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -8.66387174,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 1.1217607,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:48.637000Z",
"spacegroup": 71
},
{
"id": "mp-1097289",
"created_at": "2022-09-04T14:42:53.069762Z",
"structure_string": "Hf2 Mg1 Re1\n1.0\n-5.545386 5.960210 8.422366\n5.545386 -5.960210 8.422366\n5.545386 5.960210 -8.422366\nHf Mg Re\n2 1 1\ndirect\n0.000000 0.294798 0.294798 Hf\n0.000000 0.705202 0.705202 Hf\n0.000000 0.000000 0.000000 Mg\n0.000000 0.500000 0.500000 Re\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Hf",
"Mg",
"Re"
],
"chemical_system": "Hf-Mg-Re",
"density": 0.8462942618420547,
"density_atomic": 0.0035922995714155574,
"volume": 1113.4928812253224,
"volume_molar": 167.64027164992135,
"formula_full": "Hf2 Mg1 Re1",
"formula_reduced": "Hf2MgRe",
"formula_anonymous": "ABC2",
"energy": -19.5057393,
"energy_per_atom": -4.876434825,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -19.5057393,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 1.0000625,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:55.284000Z",
"spacegroup": 71
},
{
"id": "mp-1096629",
"created_at": "2022-09-04T14:40:36.193570Z",
"structure_string": "Li2 Tl1 Hg1\n1.0\n-5.674047 5.884363 8.338265\n5.674047 -5.884363 8.338265\n5.674047 5.884363 -8.338265\nLi Tl Hg\n2 1 1\ndirect\n0.000000 0.249256 0.249256 Li\n0.000000 0.750744 0.750744 Li\n0.000000 0.500000 0.500000 Tl\n0.000000 0.000000 0.000000 Hg\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Li",
"Tl",
"Hg"
],
"chemical_system": "Hg-Li-Tl",
"density": 0.624575641904044,
"density_atomic": 0.0035919635560188222,
"volume": 1113.597044518299,
"volume_molar": 167.65595380022958,
"formula_full": "Li2 Tl1 Hg1",
"formula_reduced": "Li2TlHg",
"formula_anonymous": "ABC2",
"energy": -3.57433,
"energy_per_atom": -0.8935825,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -3.57433,
"band_gap": 0.0882,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 1.0008642,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:06.868000Z",
"spacegroup": 71
}
]
}