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=-density_atomic&page=12107",
"previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=-density_atomic&page=12105",
"results": [
{
"id": "mp-1096631",
"created_at": "2022-09-04T14:43:00.402972Z",
"structure_string": "Hg1 Pd2 Pb1\n1.0\n-5.252137 5.886784 8.325703\n5.252137 -5.886784 8.325703\n5.252137 5.886784 -8.325703\nHg Pd Pb\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Hg\n0.000000 0.259092 0.259092 Pd\n0.000000 0.740908 0.740908 Pd\n0.000000 0.500000 0.500000 Pb\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Hg",
"Pd",
"Pb"
],
"chemical_system": "Hg-Pb-Pd",
"density": 1.0008910588611912,
"density_atomic": 0.0038847666686886015,
"volume": 1029.6628706789998,
"volume_molar": 155.01936856436535,
"formula_full": "Hg1 Pd2 Pb1",
"formula_reduced": "HgPd2Pb",
"formula_anonymous": "ABC2",
"energy": -9.84925529,
"energy_per_atom": -2.4623138225,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -9.84925529,
"band_gap": 0.6685000000000003,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 3.24e-05,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:03.506000Z",
"spacegroup": 71
},
{
"id": "mp-1095975",
"created_at": "2022-09-04T14:42:03.371394Z",
"structure_string": "La1 Y1 Pd2\n1.0\n-5.192434 5.972995 8.301534\n5.192434 -5.972995 8.301534\n5.192434 5.972995 -8.301534\nLa Y Pd\n1 1 2\ndirect\n0.000000 0.500000 0.500000 La\n0.000000 0.000000 0.000000 Y\n0.000000 0.266312 0.266312 Pd\n0.000000 0.733688 0.733688 Pd\n",
"nsites": 4,
"nelements": 3,
"elements": [
"La",
"Y",
"Pd"
],
"chemical_system": "La-Pd-Y",
"density": 0.7104977294656125,
"density_atomic": 0.00388399366463348,
"volume": 1029.8677972682706,
"volume_molar": 155.05022098351674,
"formula_full": "La1 Y1 Pd2",
"formula_reduced": "LaYPd2",
"formula_anonymous": "ABC2",
"energy": -16.24184959,
"energy_per_atom": -4.0604623975,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -16.24184959,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 2.0000295,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:46.541000Z",
"spacegroup": 71
},
{
"id": "mp-1097647",
"created_at": "2022-09-04T14:41:34.231744Z",
"structure_string": "Y2 Pd1 Pt1\n1.0\n-5.173038 5.936416 8.395026\n5.173038 -5.936416 8.395026\n5.173038 5.936416 -8.395026\nY Pd Pt\n2 1 1\ndirect\n0.000000 0.251023 0.251023 Y\n0.000000 0.748977 0.748977 Y\n0.000000 0.000000 0.000000 Pd\n0.000000 0.500000 0.500000 Pt\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Y",
"Pd",
"Pt"
],
"chemical_system": "Pd-Pt-Y",
"density": 0.771824783167133,
"density_atomic": 0.0038788944221065285,
"volume": 1031.22167419749,
"volume_molar": 155.2540519195036,
"formula_full": "Y2 Pd1 Pt1",
"formula_reduced": "Y2PdPt",
"formula_anonymous": "ABC2",
"energy": -18.37941761,
"energy_per_atom": -4.5948544025,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -18.37941761,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 0.9606839,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:25.300000Z",
"spacegroup": 71
},
{
"id": "mp-1093820",
"created_at": "2022-09-04T14:40:04.937805Z",
"structure_string": "Ca2 Cu1 Rh1\n1.0\n-5.249002 5.900333 8.326909\n5.249002 -5.900333 8.326909\n5.249002 5.900333 -8.326909\nCa Cu Rh\n2 1 1\ndirect\n0.000000 0.275153 0.275153 Ca\n0.000000 0.724847 0.724847 Ca\n0.000000 0.000000 0.000000 Cu\n0.000000 0.500000 0.500000 Rh\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ca",
"Cu",
"Rh"
],
"chemical_system": "Ca-Cu-Rh",
"density": 0.3969705665009988,
"density_atomic": 0.0038775992293374694,
"volume": 1031.5661220830818,
"volume_molar": 155.3059097607916,
"formula_full": "Ca2 Cu1 Rh1",
"formula_reduced": "Ca2CuRh",
"formula_anonymous": "ABC2",
"energy": -9.89400266,
"energy_per_atom": -2.473500665,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -9.89400266,
"band_gap": 0.569,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 1e-06,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:47.115000Z",
"spacegroup": 71
},
{
"id": "mp-1097231",
"created_at": "2022-09-04T14:42:57.468094Z",
"structure_string": "Y2 Be1 Pd1\n1.0\n-5.192063 5.931633 8.381051\n5.192063 -5.931633 8.381051\n5.192063 5.931633 -8.381051\nY Be Pd\n2 1 1\ndirect\n0.000000 0.253789 0.253789 Y\n0.000000 0.746211 0.746211 Y\n0.000000 0.000000 0.000000 Be\n0.000000 0.500000 0.500000 Pd\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Y",
"Be",
"Pd"
],
"chemical_system": "Be-Pd-Y",
"density": 0.4716342724832532,
"density_atomic": 0.003874246866116545,
"volume": 1032.4587302330342,
"volume_molar": 155.44029505885499,
"formula_full": "Y2 Be1 Pd1",
"formula_reduced": "Y2BePd",
"formula_anonymous": "ABC2",
"energy": -12.87649868,
"energy_per_atom": -3.21912467,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -12.87649868,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 2.1246743,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:57.198000Z",
"spacegroup": 71
},
{
"id": "mp-1097476",
"created_at": "2022-09-04T14:44:03.705809Z",
"structure_string": "Zr1 Sc1 Co2\n1.0\n-4.531251 6.304181 9.036498\n4.531251 -6.304181 9.036498\n4.531251 6.304181 -9.036498\nZr Sc Co\n1 1 2\ndirect\n0.000000 0.500000 0.500000 Zr\n0.000000 0.000000 0.000000 Sc\n0.000000 0.259035 0.259035 Co\n0.000000 0.740965 0.740965 Co\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Zr",
"Sc",
"Co"
],
"chemical_system": "Co-Sc-Zr",
"density": 0.4085592365994323,
"density_atomic": 0.003873941424189969,
"volume": 1032.5401347121272,
"volume_molar": 155.4525507896448,
"formula_full": "Zr1 Sc1 Co2",
"formula_reduced": "ZrScCo2",
"formula_anonymous": "ABC2",
"energy": -18.14121852,
"energy_per_atom": -4.53530463,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -18.14121852,
"band_gap": 0.4316,
"is_gap_direct": true,
"is_magnetic": false,
"total_magnetization": 0.0020975,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:21.730000Z",
"spacegroup": 71
},
{
"id": "mp-1207051",
"created_at": "2022-09-04T14:45:22.131741Z",
"structure_string": "K1 Sm3 O6\n1.0\n5.770127 -7.413154 0.000000\n5.770127 7.413154 0.000000\n0.000000 0.000000 30.176177\nK Sm O\n1 3 6\ndirect\n0.000000 0.000000 0.000000 K\n0.000000 0.000000 0.500000 Sm\n0.500000 0.000000 0.000000 Sm\n0.000000 0.500000 0.000000 Sm\n0.000000 0.000000 0.230596 O\n0.000000 0.000000 0.769404 O\n0.296758 0.035809 0.000000 O\n0.703242 0.964191 0.000000 O\n0.035809 0.296758 0.000000 O\n0.964191 0.703242 0.000000 O\n",
"nsites": 10,
"nelements": 3,
"elements": [
"K",
"Sm",
"O"
],
"chemical_system": "K-O-Sm",
"density": 0.37704532381060024,
"density_atomic": 0.0038736233646247307,
"volume": 2581.5622890246536,
"volume_molar": 155.46531485214268,
"formula_full": "K1 Sm3 O6",
"formula_reduced": "KSm3O6",
"formula_anonymous": "AB3C6",
"energy": -45.84057927,
"energy_per_atom": -4.584057927,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -41.71857926999999,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 5.4864682,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:05.713000Z",
"spacegroup": 65
},
{
"id": "mp-1093744",
"created_at": "2022-09-04T14:43:15.840836Z",
"structure_string": "Sc1 Ag2 Sn1\n1.0\n-5.408726 5.766432 8.279956\n5.408726 -5.766432 8.279956\n5.408726 5.766432 -8.279956\nSc Ag Sn\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Sc\n0.000000 0.250087 0.250087 Ag\n0.000000 0.749913 0.749913 Ag\n0.000000 0.500000 0.500000 Sn\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sc",
"Ag",
"Sn"
],
"chemical_system": "Ag-Sc-Sn",
"density": 0.6099003661903803,
"density_atomic": 0.0038723073000601995,
"volume": 1032.9758694352113,
"volume_molar": 155.51815218555558,
"formula_full": "Sc1 Ag2 Sn1",
"formula_reduced": "ScAg2Sn",
"formula_anonymous": "ABC2",
"energy": -9.21433796,
"energy_per_atom": -2.30358449,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -9.21433796,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 2.7249434,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:12.394000Z",
"spacegroup": 71
},
{
"id": "mp-1093552",
"created_at": "2022-09-04T14:47:00.838446Z",
"structure_string": "Mg2 Cd1 Pt1\n1.0\n-5.229674 5.918513 8.344034\n5.229674 -5.918513 8.344034\n5.229674 5.918513 -8.344034\nMg Cd Pt\n2 1 1\ndirect\n0.000000 0.268892 0.268892 Mg\n0.000000 0.731108 0.731108 Mg\n0.000000 0.000000 0.000000 Cd\n0.000000 0.500000 0.500000 Pt\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Mg",
"Cd",
"Pt"
],
"chemical_system": "Cd-Mg-Pt",
"density": 0.572405620485158,
"density_atomic": 0.0038720121532334643,
"volume": 1033.05460874126,
"volume_molar": 155.53000666516485,
"formula_full": "Mg2 Cd1 Pt1",
"formula_reduced": "Mg2CdPt",
"formula_anonymous": "ABC2",
"energy": -5.63971305,
"energy_per_atom": -1.4099282625,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -5.63971305,
"band_gap": 0.0735999999999998,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 5.22e-05,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:52.411000Z",
"spacegroup": 71
},
{
"id": "mp-1093970",
"created_at": "2022-09-04T14:42:17.493133Z",
"structure_string": "Hf2 Ni1 Mo1\n1.0\n-4.789896 6.132624 8.794665\n4.789896 -6.132624 8.794665\n4.789896 6.132624 -8.794665\nHf Ni Mo\n2 1 1\ndirect\n0.000000 0.249970 0.249970 Hf\n0.000000 0.750030 0.750030 Hf\n0.000000 0.000000 0.000000 Ni\n0.000000 0.500000 0.500000 Mo\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Hf",
"Ni",
"Mo"
],
"chemical_system": "Hf-Mo-Ni",
"density": 0.8221277232900196,
"density_atomic": 0.0038708672400384956,
"volume": 1033.3601624529547,
"volume_molar": 155.576008851704,
"formula_full": "Hf2 Ni1 Mo1",
"formula_reduced": "Hf2NiMo",
"formula_anonymous": "ABC2",
"energy": -22.34173112,
"energy_per_atom": -5.58543278,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -22.34173112,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 3.3394665,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:45.940000Z",
"spacegroup": 71
},
{
"id": "mp-1095790",
"created_at": "2022-09-04T14:43:05.120276Z",
"structure_string": "Mg2 Zn1 Ag1\n1.0\n-5.499054 5.774265 8.148287\n5.499054 -5.774265 8.148287\n5.499054 5.774265 -8.148287\nMg Zn Ag\n2 1 1\ndirect\n0.000000 0.256157 0.256157 Mg\n0.000000 0.743843 0.743843 Mg\n0.000000 0.000000 0.000000 Zn\n0.000000 0.500000 0.500000 Ag\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Mg",
"Zn",
"Ag"
],
"chemical_system": "Ag-Mg-Zn",
"density": 0.356016677593046,
"density_atomic": 0.0038649954501454352,
"volume": 1034.9300669550555,
"volume_molar": 155.8123634989892,
"formula_full": "Mg2 Zn1 Ag1",
"formula_reduced": "Mg2ZnAg",
"formula_anonymous": "ABC2",
"energy": -3.30510364,
"energy_per_atom": -0.82627591,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -3.30510364,
"band_gap": 0.0056,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0007171,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:58.078000Z",
"spacegroup": 71
},
{
"id": "mp-1096008",
"created_at": "2022-09-04T14:47:21.971959Z",
"structure_string": "Nb1 Mo1 W2\n1.0\n-4.584028 6.650913 8.490044\n4.584028 -6.650913 8.490044\n4.584028 6.650913 -8.490044\nNb Mo W\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Nb\n0.000000 0.500000 0.500000 Mo\n0.000000 0.252993 0.252993 W\n0.000000 0.747007 0.747007 W\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Nb",
"Mo",
"W"
],
"chemical_system": "Mo-Nb-W",
"density": 0.8925578865995449,
"density_atomic": 0.0038633275435447285,
"volume": 1035.3768752234428,
"volume_molar": 155.87963205611322,
"formula_full": "Nb1 Mo1 W2",
"formula_reduced": "NbMoW2",
"formula_anonymous": "ABC2",
"energy": -26.78720669,
"energy_per_atom": -6.6968016725,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -26.78720669,
"band_gap": 0.0,
"is_gap_direct": true,
"is_magnetic": true,
"total_magnetization": 0.0642371,
"is_theoretical": true,
"updated_at": "2021-11-28T01:38:05.929000Z",
"spacegroup": 71
}
]
}