HTTP 200 OK
Allow: GET, HEAD, OPTIONS
Content-Type: application/json
Vary: Accept
{
"count": 55712,
"next": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=energy_above_hull&page=1063",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=energy_above_hull&page=1061",
"results": [
{
"id": "jvasp-35994",
"created_at": "2022-09-04T14:37:27.680582Z",
"updated_at": "2022-09-04T14:37:27.680604Z",
"structure_string": "Ho1 Bi1\n1.0\n3.863515 -0.000000 -0.000000\n-0.000000 3.863515 -0.000000\n-0.000000 0.000000 3.863515\nHo Bi\n1 1\ndirect\n0.000000 0.000000 0.000000 Ho\n0.499999 0.499999 0.499999 Bi\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Ho",
"Bi"
],
"chemical_system": "Bi-Ho",
"density": 10.766367645227005,
"density_atomic": 0.034680247442957994,
"volume": 57.669715398934116,
"volume_molar": 17.36475718607604,
"formula_full": "Ho1 Bi1",
"formula_reduced": "HoBi",
"formula_anonymous": "AB",
"energy_above_hull": 0.4730699333333332,
"spacegroup": 221
},
{
"id": "jvasp-115038",
"created_at": "2022-09-04T14:38:42.603343Z",
"updated_at": "2022-09-04T14:38:42.603370Z",
"structure_string": "Na1 Ge1 Se1\n1.0\n3.084282 0.000000 -0.000000\n-0.000000 3.084282 -0.000000\n-0.000000 -0.000000 8.105505\nNa Ge Se\n1 1 1\ndirect\n0.000000 0.000000 0.653424 Na\n0.000000 0.000000 0.296709 Ge\n0.000000 0.000000 -0.005873 Se\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Na",
"Ge",
"Se"
],
"chemical_system": "Ge-Na-Se",
"density": 3.759929067451251,
"density_atomic": 0.038907472401750305,
"volume": 77.10601112872706,
"volume_molar": 15.478108415310695,
"formula_full": "Na1 Ge1 Se1",
"formula_reduced": "NaGeSe",
"formula_anonymous": "ABC",
"energy_above_hull": 0.4731294388888888,
"spacegroup": 99
},
{
"id": "jvasp-36290",
"created_at": "2022-09-04T14:37:15.028970Z",
"updated_at": "2022-09-04T14:37:15.028994Z",
"structure_string": "Li1 Cu1 O1\n1.0\n2.458955 2.458955 0.000000\n2.458955 0.000000 -2.458955\n-0.000000 2.458955 -2.458955\nLi Cu O\n1 1 1\ndirect\n0.499999 0.499999 0.499999 Li\n0.000000 0.000000 0.000000 Cu\n0.749999 0.749999 0.749999 O\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Li",
"Cu",
"O"
],
"chemical_system": "Cu-Li-O",
"density": 4.8296446586343285,
"density_atomic": 0.10088800076704256,
"volume": 29.73594458400667,
"volume_molar": 5.969134797214927,
"formula_full": "Li1 Cu1 O1",
"formula_reduced": "LiCuO",
"formula_anonymous": "ABC",
"energy_above_hull": 0.4731913166666669,
"spacegroup": 216
},
{
"id": "jvasp-39080",
"created_at": "2022-09-04T14:38:02.176270Z",
"updated_at": "2022-09-04T14:38:02.176287Z",
"structure_string": "Sm1 Ag2 Ge2\n1.0\n-2.131193 2.131193 5.584316\n2.131193 -2.131193 5.584316\n2.131193 2.131193 -5.584316\nSm Ag Ge\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Sm\n0.250000 0.749999 0.499998 Ag\n0.749999 0.250000 0.499998 Ag\n0.390859 0.390859 0.000000 Ge\n0.609142 0.609142 0.000000 Ge\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Sm",
"Ag",
"Ge"
],
"chemical_system": "Ag-Ge-Sm",
"density": 8.369783798532094,
"density_atomic": 0.0492826968383233,
"volume": 101.45548682944418,
"volume_molar": 12.219584451224781,
"formula_full": "Sm1 Ag2 Ge2",
"formula_reduced": "Sm(AgGe)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 0.4732730589999997,
"spacegroup": 139
},
{
"id": "jvasp-108837",
"created_at": "2022-09-04T14:38:18.319478Z",
"updated_at": "2022-09-04T14:38:18.319504Z",
"structure_string": "Pm2 Tl1 Ag1\n1.0\n4.646338 -0.000000 2.682564\n1.548779 4.380609 2.682564\n-0.000000 -0.000000 5.365129\nPm Tl Ag\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Pm\n0.750000 0.750000 0.749999 Pm\n0.000000 0.000000 0.000000 Tl\n0.500000 0.500000 0.499999 Ag\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Pm",
"Tl",
"Ag"
],
"chemical_system": "Ag-Pm-Tl",
"density": 9.158018752696362,
"density_atomic": 0.036629798700719605,
"volume": 109.20070930997004,
"volume_molar": 16.44055106391205,
"formula_full": "Pm2 Tl1 Ag1",
"formula_reduced": "Pm2TlAg",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.4733130524999999,
"spacegroup": 225
},
{
"id": "jvasp-118067",
"created_at": "2022-09-04T14:38:54.134442Z",
"updated_at": "2022-09-04T14:38:54.134469Z",
"structure_string": "Zn1 H1 Cl1\n1.0\n4.234911 -0.000000 -0.000000\n-2.117456 3.667541 0.000000\n0.000000 -0.000000 3.579814\nZn H Cl\n1 1 1\ndirect\n0.666667 0.333334 0.000000 Zn\n0.333334 0.666667 0.000000 H\n0.000000 0.000000 0.000000 Cl\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Zn",
"H",
"Cl"
],
"chemical_system": "Cl-H-Zn",
"density": 3.0423937509511836,
"density_atomic": 0.053956221301113966,
"volume": 55.600631913377946,
"volume_molar": 11.161161057577003,
"formula_full": "Zn1 H1 Cl1",
"formula_reduced": "ZnHCl",
"formula_anonymous": "ABC",
"energy_above_hull": 0.4733281558333334,
"spacegroup": 187
},
{
"id": "jvasp-29585",
"created_at": "2022-09-04T14:37:00.243517Z",
"updated_at": "2022-09-04T14:37:00.243545Z",
"structure_string": "Sm2 Al4 Cl16\n1.0\n6.822673 0.000000 0.000000\n0.000000 6.459630 -0.333908\n0.000000 0.282725 13.016358\nSm Al Cl\n2 4 16\ndirect\n0.824220 0.500001 0.750000 Sm\n0.175780 0.500000 0.250000 Sm\n0.257770 0.667590 0.912403 Al\n0.742230 0.332410 0.087597 Al\n0.257770 0.332411 0.587597 Al\n0.742230 0.667590 0.412403 Al\n0.000098 0.156835 0.128974 Cl\n0.660879 0.286727 0.927599 Cl\n0.843938 0.643369 0.127276 Cl\n0.156061 0.643369 0.627276 Cl\n0.492621 0.767229 0.321726 Cl\n0.507378 0.767229 0.821726 Cl\n0.339120 0.286727 0.427599 Cl\n0.507378 0.232772 0.678274 Cl\n0.492621 0.232771 0.178274 Cl\n0.000098 0.843165 0.371026 Cl\n0.843938 0.356632 0.372724 Cl\n-0.000098 0.843166 0.871026 Cl\n0.156061 0.356632 0.872724 Cl\n0.339120 0.713273 0.072401 Cl\n0.660879 0.713274 0.572401 Cl\n-0.000098 0.156836 0.628974 Cl\n",
"nsites": 22,
"nelements": 3,
"elements": [
"Sm",
"Al",
"Cl"
],
"chemical_system": "Al-Cl-Sm",
"density": 2.8217126610949164,
"density_atomic": 0.03830748618486878,
"volume": 574.3002789018785,
"volume_molar": 15.720532354792594,
"formula_full": "Sm2 Al4 Cl16",
"formula_reduced": "Sm(AlCl4)2",
"formula_anonymous": "AB2C8",
"energy_above_hull": 0.4735342740909091,
"spacegroup": 13
},
{
"id": "jvasp-115403",
"created_at": "2022-09-04T14:38:46.708787Z",
"updated_at": "2022-09-04T14:38:46.708817Z",
"structure_string": "As1 I1 F1\n1.0\n4.795787 -0.000000 -0.000000\n-2.397894 4.153274 0.000000\n-0.000000 0.000000 3.509973\nAs I F\n1 1 1\ndirect\n0.000000 0.000000 0.000000 As\n0.666668 0.333333 0.000000 I\n0.333333 0.666665 0.000000 F\n",
"nsites": 3,
"nelements": 3,
"elements": [
"As",
"I",
"F"
],
"chemical_system": "As-F-I",
"density": 5.244958488947949,
"density_atomic": 0.04291083934765188,
"volume": 69.91240548092804,
"volume_molar": 14.034078222544805,
"formula_full": "As1 I1 F1",
"formula_reduced": "AsIF",
"formula_anonymous": "ABC",
"energy_above_hull": 0.4738770875,
"spacegroup": 187
},
{
"id": "jvasp-58032",
"created_at": "2022-09-04T14:37:31.543125Z",
"updated_at": "2022-09-04T14:37:31.543152Z",
"structure_string": "Mg4 Cu4 O8\n1.0\n3.129482 0.170523 0.024566\n-0.785193 7.976847 0.284457\n-1.443005 -2.588947 7.522462\nMg Cu O\n4 4 8\ndirect\n0.627502 0.752676 0.140833 Mg\n0.533801 0.226294 0.862554 Mg\n0.964978 0.828298 0.780250 Mg\n0.072790 0.091849 0.181483 Mg\n0.368195 0.424971 0.252054 Cu\n0.197377 0.822606 0.477537 Cu\n0.814346 0.146769 0.516519 Cu\n0.216530 0.478319 0.653741 Cu\n0.736443 0.346154 0.693510 O\n0.633081 0.236399 0.318861 O\n0.395492 0.705646 0.649094 O\n0.185881 0.642874 0.258137 O\n0.111248 0.245942 0.020588 O\n0.909838 0.955808 0.344271 O\n0.088358 0.847483 0.024741 O\n0.115570 0.025364 0.683677 O\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Mg",
"Cu",
"O"
],
"chemical_system": "Cu-Mg-O",
"density": 4.160000212285546,
"density_atomic": 0.08361167677766976,
"volume": 191.36083160424232,
"volume_molar": 7.202511649196274,
"formula_full": "Mg4 Cu4 O8",
"formula_reduced": "MgCuO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.4739066249999999,
"spacegroup": 1
},
{
"id": "jvasp-94078",
"created_at": "2022-09-04T14:36:13.541946Z",
"updated_at": "2022-09-04T14:36:13.541975Z",
"structure_string": "Mg6 Ti1 V1\n1.0\n6.296592 -0.104258 0.000000\n-3.238586 5.400879 0.000000\n0.000000 0.000000 4.835742\nMg Ti V\n6 1 1\ndirect\n0.178443 0.838365 0.250000 Mg\n0.661634 0.321556 0.250000 Mg\n0.671036 0.828963 0.250000 Mg\n0.319974 0.662238 0.750000 Mg\n0.837761 0.180025 0.750000 Mg\n0.831627 0.668372 0.750000 Mg\n0.312499 0.187501 0.750000 Ti\n0.187020 0.312980 0.250000 V\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Mg",
"Ti",
"V"
],
"chemical_system": "Mg-Ti-V",
"density": 2.4950217323450414,
"density_atomic": 0.049134938537093165,
"volume": 162.8169330864351,
"volume_molar": 12.25633111447517,
"formula_full": "Mg6 Ti1 V1",
"formula_reduced": "Mg6TiV",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.4739283541666667,
"spacegroup": 38
},
{
"id": "jvasp-41003",
"created_at": "2022-09-04T14:37:35.308222Z",
"updated_at": "2022-09-04T14:37:35.308244Z",
"structure_string": "Nd2 Mg1 Tl1\n1.0\n0.000000 3.873145 3.873145\n3.873145 0.000000 3.873145\n3.873145 3.873145 0.000000\nNd Mg Tl\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Nd\n0.499999 0.499999 0.499999 Nd\n0.250000 0.250000 0.250000 Mg\n0.749999 0.749999 0.749999 Tl\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Nd",
"Mg",
"Tl"
],
"chemical_system": "Mg-Nd-Tl",
"density": 7.390317373053213,
"density_atomic": 0.03442220822498038,
"volume": 116.20404983481505,
"volume_molar": 17.494928624682775,
"formula_full": "Nd2 Mg1 Tl1",
"formula_reduced": "Nd2MgTl",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.4741391937500001,
"spacegroup": 225
},
{
"id": "jvasp-52281",
"created_at": "2022-09-04T14:36:57.592539Z",
"updated_at": "2022-09-04T14:36:57.592562Z",
"structure_string": "Mg3 Zn1 O4\n1.0\n0.000000 2.130036 2.130036\n-4.254379 2.126179 -2.126179\n-4.254379 -2.126179 2.126179\nMg Zn O\n3 1 4\ndirect\n-0.000000 0.500000 0.500000 Mg\n0.500001 -0.000000 0.500000 Mg\n0.500001 0.500000 -0.000000 Mg\n0.000000 0.000000 0.000000 Zn\n-0.000000 0.746684 0.746684 O\n0.500001 0.256149 0.743851 O\n0.500001 0.743851 0.256149 O\n-0.000000 0.253316 0.253316 O\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Mg",
"Zn",
"O"
],
"chemical_system": "Mg-O-Zn",
"density": 4.359216239325104,
"density_atomic": 0.10380231791589503,
"volume": 77.06956993467077,
"volume_molar": 5.801547480740642,
"formula_full": "Mg3 Zn1 O4",
"formula_reduced": "Mg3ZnO4",
"formula_anonymous": "AB3C4",
"energy_above_hull": 0.4741401937499999,
"spacegroup": 65
}
]
}