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=518",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=energy_above_hull&page=516",
"results": [
{
"id": "jvasp-110951",
"created_at": "2022-09-04T14:38:37.386130Z",
"updated_at": "2022-09-04T14:38:37.386148Z",
"structure_string": "Zn1 Hg1 S2\n1.0\n3.863093 0.012124 5.919894\n1.769721 3.433908 5.919894\n0.019817 0.012124 7.068822\nZn Hg S\n1 1 2\ndirect\n0.499220 0.499219 0.499220 Zn\n0.003835 0.003835 0.003835 Hg\n0.131229 0.131229 0.131229 S\n0.615716 0.615715 0.615715 S\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Zn",
"Hg",
"S"
],
"chemical_system": "Hg-S-Zn",
"density": 5.89022183645256,
"density_atomic": 0.04297925358753855,
"volume": 93.06815884675494,
"volume_molar": 14.011738821229939,
"formula_full": "Zn1 Hg1 S2",
"formula_reduced": "ZnHgS2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0294987499999999,
"spacegroup": 160
},
{
"id": "jvasp-109016",
"created_at": "2022-09-04T14:37:47.049284Z",
"updated_at": "2022-09-04T14:37:47.049317Z",
"structure_string": "Ac1 Ag2 Pb1\n1.0\n4.598709 -0.000000 2.655066\n1.532903 4.335705 2.655066\n-0.000000 -0.000000 5.310132\nAc Ag Pb\n1 2 1\ndirect\n0.500000 0.499999 0.500001 Ac\n0.750000 0.749999 0.750001 Ag\n0.250000 0.250000 0.250000 Ag\n0.000000 0.000000 0.000000 Pb\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ac",
"Ag",
"Pb"
],
"chemical_system": "Ac-Ag-Pb",
"density": 10.193398125253099,
"density_atomic": 0.037779744820698145,
"volume": 105.8768400629468,
"volume_molar": 15.940130852076823,
"formula_full": "Ac1 Ag2 Pb1",
"formula_reduced": "AcAg2Pb",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.029501335,
"spacegroup": 225
},
{
"id": "jvasp-25389",
"created_at": "2022-09-04T14:38:01.272400Z",
"updated_at": "2022-09-04T14:38:01.272427Z",
"structure_string": "Rb2\n1.0\n4.950130 0.000000 0.000000\n2.475065 4.293813 -0.000000\n0.000000 0.000000 8.063834\nRb\n2\ndirect\n0.834050 0.331902 0.250000 Rb\n0.165951 0.668096 0.750000 Rb\n",
"nsites": 2,
"nelements": 1,
"elements": [
"Rb"
],
"chemical_system": "Rb",
"density": 1.6560761710515686,
"density_atomic": 0.01166886688881764,
"volume": 171.39624772964157,
"volume_molar": 51.6086164781866,
"formula_full": "Rb2",
"formula_reduced": "Rb",
"formula_anonymous": "A",
"energy_above_hull": 0.0295100000000001,
"spacegroup": 194
},
{
"id": "jvasp-39062",
"created_at": "2022-09-04T14:37:58.107605Z",
"updated_at": "2022-09-04T14:37:58.107627Z",
"structure_string": "Sm1 Hg1 Au2\n1.0\n0.000000 3.533792 3.533792\n3.533792 0.000000 3.533792\n3.533792 3.533792 0.000000\nSm Hg Au\n1 1 2\ndirect\n0.750000 0.750000 0.750000 Sm\n0.250000 0.250000 0.250000 Hg\n0.500000 0.500000 0.500000 Au\n0.000000 0.000000 0.000000 Au\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sm",
"Hg",
"Au"
],
"chemical_system": "Au-Hg-Sm",
"density": 14.014715802281852,
"density_atomic": 0.045321789148570574,
"volume": 88.25776905866387,
"volume_molar": 13.287517710871162,
"formula_full": "Sm1 Hg1 Au2",
"formula_reduced": "SmHgAu2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0295471537499999,
"spacegroup": 225
},
{
"id": "jvasp-25388",
"created_at": "2022-09-04T14:37:56.707914Z",
"updated_at": "2022-09-04T14:37:56.707944Z",
"structure_string": "Rb2\n1.0\n4.953811 -0.000000 0.000000\n-2.476905 4.290126 -0.000000\n-0.000000 -0.000000 8.066340\nRb\n2\ndirect\n0.333334 0.666668 0.250001 Rb\n0.666667 0.333332 0.750001 Rb\n",
"nsites": 2,
"nelements": 1,
"elements": [
"Rb"
],
"chemical_system": "Rb",
"density": 1.6557532407540902,
"density_atomic": 0.01166659149187545,
"volume": 171.42967604486614,
"volume_molar": 51.6186819791692,
"formula_full": "Rb2",
"formula_reduced": "Rb",
"formula_anonymous": "A",
"energy_above_hull": 0.0296,
"spacegroup": 194
},
{
"id": "jvasp-50804",
"created_at": "2022-09-04T14:37:14.188115Z",
"updated_at": "2022-09-04T14:37:14.188125Z",
"structure_string": "Li2 Ag2 F4\n1.0\n4.657112 0.000000 -0.000000\n-2.328557 5.112766 -0.016794\n-0.000000 2.134630 4.139089\nLi Ag F\n2 2 4\ndirect\n0.250000 0.500000 0.250001 Li\n0.500000 -0.000000 0.500000 Li\n0.000000 0.000000 0.000000 Ag\n0.749999 0.500000 0.750001 Ag\n0.042860 0.085720 0.457140 F\n0.292859 0.585720 0.707141 F\n0.457139 0.914281 0.042861 F\n0.707140 0.414280 0.292860 F\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Li",
"Ag",
"F"
],
"chemical_system": "Ag-F-Li",
"density": 5.140520292635041,
"density_atomic": 0.08103591611849799,
"volume": 98.72165803989533,
"volume_molar": 7.431446509710443,
"formula_full": "Li2 Ag2 F4",
"formula_reduced": "LiAgF2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0296075,
"spacegroup": 141
},
{
"id": "jvasp-66578",
"created_at": "2022-09-04T14:35:57.051452Z",
"updated_at": "2022-09-04T14:35:57.051477Z",
"structure_string": "Ba1 Cd1 Se1\n1.0\n0.000000 3.857573 3.857573\n3.857573 -0.000000 3.857573\n3.857573 3.857573 -0.000000\nBa Cd Se\n1 1 1\ndirect\n0.749999 0.749999 0.749999 Ba\n0.000000 0.000000 0.000000 Cd\n0.500000 0.500000 0.500000 Se\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ba",
"Cd",
"Se"
],
"chemical_system": "Ba-Cd-Se",
"density": 4.754159011582396,
"density_atomic": 0.0261305649316993,
"volume": 114.80808041622798,
"volume_molar": 23.046347355064146,
"formula_full": "Ba1 Cd1 Se1",
"formula_reduced": "BaCdSe",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0296582227777777,
"spacegroup": 216
},
{
"id": "jvasp-93189",
"created_at": "2022-09-04T14:36:18.293709Z",
"updated_at": "2022-09-04T14:36:18.293735Z",
"structure_string": "Li1 Mg6 B1\n1.0\n6.722596 1.289090 0.000000\n-2.244913 6.466481 0.000000\n0.000000 0.000000 3.383397\nLi Mg B\n1 6 1\ndirect\n0.125943 0.374057 0.250000 Li\n0.217160 0.949144 0.250000 Mg\n0.550856 0.282840 0.250000 Mg\n0.654124 0.845877 0.250000 Mg\n0.372708 0.590331 0.750001 Mg\n0.909670 0.127292 0.750001 Mg\n0.892852 0.607149 0.750001 Mg\n0.276691 0.223309 0.750001 B\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Li",
"Mg",
"B"
],
"chemical_system": "B-Li-Mg",
"density": 1.7315591038264768,
"density_atomic": 0.05099677304889822,
"volume": 156.87267098898994,
"volume_molar": 11.808866326160823,
"formula_full": "Li1 Mg6 B1",
"formula_reduced": "LiMg6B",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.0296983604166666,
"spacegroup": 38
},
{
"id": "jvasp-106643",
"created_at": "2022-09-04T14:36:57.530899Z",
"updated_at": "2022-09-04T14:36:57.530933Z",
"structure_string": "Er3 Mg3 Au3\n1.0\n7.472316 0.000000 0.000000\n-3.736158 6.471216 0.000000\n-0.000000 -0.000000 4.100836\nEr Mg Au\n3 3 3\ndirect\n0.589376 -0.000000 -0.000000 Er\n0.000000 0.589376 -0.000000 Er\n0.410625 0.410625 -0.000000 Er\n0.247491 -0.000000 0.500001 Mg\n0.000000 0.247491 0.500001 Mg\n0.752510 0.752510 0.500001 Mg\n0.333334 0.666667 0.500001 Au\n0.666667 0.333334 0.500001 Au\n0.000000 0.000000 0.000000 Au\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Er",
"Mg",
"Au"
],
"chemical_system": "Au-Er-Mg",
"density": 9.76072369548787,
"density_atomic": 0.0453867392097083,
"volume": 198.29580526628544,
"volume_molar": 13.268502793679112,
"formula_full": "Er3 Mg3 Au3",
"formula_reduced": "ErMgAu",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0297388733333333,
"spacegroup": 189
},
{
"id": "jvasp-85283",
"created_at": "2022-09-04T14:36:00.490099Z",
"updated_at": "2022-09-04T14:36:00.490134Z",
"structure_string": "I8 Cl8\n1.0\n4.327785 0.000000 0.000000\n0.000000 15.209240 -1.534987\n0.000000 1.952732 8.575751\nI Cl\n8 8\ndirect\n0.512219 0.764401 0.178638 I\n0.012220 0.735599 0.821362 I\n0.753238 0.410873 0.745817 I\n0.746760 0.910873 0.745817 I\n0.253239 0.089127 0.254183 I\n-0.012220 0.264401 0.178638 I\n0.246761 0.589127 0.254183 I\n0.487780 0.235599 0.821362 I\n0.255969 0.585243 0.931012 Cl\n0.744029 0.414757 0.068987 Cl\n0.238807 0.596323 0.527635 Cl\n0.755969 0.914757 0.068987 Cl\n0.261193 0.096323 0.527636 Cl\n0.244030 0.085243 0.931013 Cl\n0.761192 0.403677 0.472364 Cl\n-0.261193 0.903677 0.472364 Cl\n",
"nsites": 16,
"nelements": 2,
"elements": [
"I",
"Cl"
],
"chemical_system": "Cl-I",
"density": 3.735067606538113,
"density_atomic": 0.027708121939153087,
"volume": 577.4480145257022,
"volume_molar": 21.734207656601896,
"formula_full": "I8 Cl8",
"formula_reduced": "ICl",
"formula_anonymous": "AB",
"energy_above_hull": 0.0297980225,
"spacegroup": 14
},
{
"id": "jvasp-25355",
"created_at": "2022-09-04T14:37:48.260536Z",
"updated_at": "2022-09-04T14:37:48.260556Z",
"structure_string": "Rb3\n1.0\n2.476027 -4.288605 0.000000\n2.476027 4.288605 -0.000000\n0.000000 -2.859069 12.104476\nRb\n3\ndirect\n0.000000 0.000000 0.000000 Rb\n0.222204 0.777797 0.333390 Rb\n0.777797 0.222204 0.666611 Rb\n",
"nsites": 3,
"nelements": 1,
"elements": [
"Rb"
],
"chemical_system": "Rb",
"density": 1.6562483710908293,
"density_atomic": 0.01167008022632681,
"volume": 257.0676415087729,
"volume_molar": 51.60325073356831,
"formula_full": "Rb3",
"formula_reduced": "Rb",
"formula_anonymous": "A",
"energy_above_hull": 0.0298200000000001,
"spacegroup": 166
},
{
"id": "jvasp-25265",
"created_at": "2022-09-04T14:38:29.100650Z",
"updated_at": "2022-09-04T14:38:29.100671Z",
"structure_string": "Rb4\n1.0\n4.950203 0.000000 -0.000000\n-2.475102 4.287003 -0.000000\n0.000000 -0.000000 16.146783\nRb\n4\ndirect\n0.000000 0.000000 0.000000 Rb\n0.333333 0.666667 0.750000 Rb\n0.000000 0.000000 0.500000 Rb\n0.666667 0.333333 0.250000 Rb\n",
"nsites": 4,
"nelements": 1,
"elements": [
"Rb"
],
"chemical_system": "Rb",
"density": 1.656718831020132,
"density_atomic": 0.011673395130790456,
"volume": 342.65952237403127,
"volume_molar": 51.588596912269644,
"formula_full": "Rb4",
"formula_reduced": "Rb",
"formula_anonymous": "A",
"energy_above_hull": 0.02984,
"spacegroup": 194
}
]
}