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=1587",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=energy_above_hull&page=1585",
"results": [
{
"id": "jvasp-56339",
"created_at": "2022-09-04T14:37:32.054613Z",
"updated_at": "2022-09-04T14:37:32.054646Z",
"structure_string": "Mn1 Tl2 Sn1 Te4\n1.0\n6.800413 -0.054485 -1.812134\n-4.026837 5.480253 -1.812134\n0.027852 0.054485 7.037661\nMn Tl Sn Te\n1 2 1 4\ndirect\n0.500000 0.500000 0.000001 Mn\n0.500000 -0.000000 0.500000 Tl\n-0.000001 0.499999 0.500000 Tl\n0.000000 0.000000 0.000000 Sn\n0.078735 0.078735 0.645109 Te\n0.921264 0.566374 0.000001 Te\n0.433626 0.433626 0.354891 Te\n0.566373 0.921264 0.000001 Te\n",
"nsites": 8,
"nelements": 4,
"elements": [
"Mn",
"Tl",
"Sn",
"Te"
],
"chemical_system": "Mn-Sn-Te-Tl",
"density": 6.92397600453327,
"density_atomic": 0.030524596882627906,
"volume": 262.08372319416094,
"volume_molar": 19.728813399751424,
"formula_full": "Mn1 Tl2 Sn1 Te4",
"formula_reduced": "MnTl2SnTe4",
"formula_anonymous": "ABC2D4",
"energy_above_hull": 0.9961019010057472,
"spacegroup": 121
},
{
"id": "jvasp-35082",
"created_at": "2022-09-04T14:37:30.034890Z",
"updated_at": "2022-09-04T14:37:30.034920Z",
"structure_string": "Sr2 H3 I1\n1.0\n2.113640 -3.660932 0.000000\n2.113640 3.660932 -0.000000\n0.000000 -0.000000 7.635662\nSr H I\n2 3 1\ndirect\n0.666667 0.333333 0.320331 Sr\n0.333333 0.666667 0.679669 Sr\n0.000000 0.000000 0.500000 H\n0.666667 0.333333 0.645004 H\n0.333333 0.666667 0.354996 H\n0.000000 0.000000 0.000000 I\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Sr",
"H",
"I"
],
"chemical_system": "H-I-Sr",
"density": 4.288339189192647,
"density_atomic": 0.0507752274645579,
"volume": 118.16786058099133,
"volume_molar": 11.86039149544642,
"formula_full": "Sr2 H3 I1",
"formula_reduced": "Sr2H3I",
"formula_anonymous": "AB2C3",
"energy_above_hull": 0.9961414825,
"spacegroup": 164
},
{
"id": "jvasp-8507",
"created_at": "2022-09-04T14:36:50.200631Z",
"updated_at": "2022-09-04T14:36:50.200662Z",
"structure_string": "Ce1 Ni2 Sn2\n1.0\n4.116523 0.000000 -1.652757\n-0.663571 4.062688 -1.652757\n0.043178 0.050802 6.060433\nCe Ni Sn\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Ce\n0.750000 0.250000 0.499999 Ni\n0.250000 0.750000 0.499999 Ni\n0.636345 0.636345 0.272688 Sn\n0.363656 0.363655 0.727311 Sn\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Ce",
"Ni",
"Sn"
],
"chemical_system": "Ce-Ni-Sn",
"density": 8.053541770916699,
"density_atomic": 0.048997098312868644,
"volume": 102.04685934813399,
"volume_molar": 12.290811022207697,
"formula_full": "Ce1 Ni2 Sn2",
"formula_reduced": "Ce(NiSn)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 0.99638074,
"spacegroup": 139
},
{
"id": "jvasp-114430",
"created_at": "2022-09-04T14:38:41.425994Z",
"updated_at": "2022-09-04T14:38:41.426017Z",
"structure_string": "As1 S1 F1\n1.0\n2.633772 -0.000000 0.000000\n-0.000000 2.633772 -0.000000\n0.000000 -0.000000 7.604591\nAs S F\n1 1 1\ndirect\n0.000000 0.000000 0.294042 As\n0.000000 0.000000 0.664229 S\n0.000000 0.000000 0.057207 F\n",
"nsites": 3,
"nelements": 3,
"elements": [
"As",
"S",
"F"
],
"chemical_system": "As-F-S",
"density": 3.9658449873119763,
"density_atomic": 0.05687076115624502,
"volume": 52.7511842466446,
"volume_molar": 10.589168559666279,
"formula_full": "As1 S1 F1",
"formula_reduced": "AsSF",
"formula_anonymous": "ABC",
"energy_above_hull": 0.9964340108333332,
"spacegroup": 99
},
{
"id": "jvasp-74315",
"created_at": "2022-09-04T14:35:43.608439Z",
"updated_at": "2022-09-04T14:35:43.608457Z",
"structure_string": "Be1 Bi2 Cl1\n1.0\n-2.548625 2.548625 3.604359\n2.548625 -2.548625 3.604359\n2.548625 2.548625 -3.604359\nBe Bi Cl\n1 2 1\ndirect\n0.750001 0.250000 0.500001 Be\n0.000000 0.000000 0.000000 Bi\n0.500000 0.500000 0.000000 Bi\n0.250000 0.750001 0.500001 Cl\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Bi",
"Cl"
],
"chemical_system": "Be-Bi-Cl",
"density": 8.199576365862892,
"density_atomic": 0.042713000555111486,
"volume": 93.64830257801493,
"volume_molar": 14.09908150149692,
"formula_full": "Be1 Bi2 Cl1",
"formula_reduced": "BeBi2Cl",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.996502191875,
"spacegroup": 225
},
{
"id": "jvasp-99900",
"created_at": "2022-09-04T14:36:20.632611Z",
"updated_at": "2022-09-04T14:36:20.632635Z",
"structure_string": "Zn2 Fe1 S3\n1.0\n3.813921 0.000000 -0.000000\n-1.906961 3.302953 -0.000000\n-0.000000 0.000000 9.399401\nZn Fe S\n2 1 3\ndirect\n0.666667 0.333333 0.333178 Zn\n0.333333 0.666666 0.668792 Zn\n0.000000 0.000000 -0.001100 Fe\n0.000000 0.000000 0.246397 S\n0.666667 0.333333 0.583373 S\n0.333333 0.666666 0.919361 S\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Zn",
"Fe",
"S"
],
"chemical_system": "Fe-S-Zn",
"density": 3.96682735002078,
"density_atomic": 0.05067304304074492,
"volume": 118.40615127801878,
"volume_molar": 11.884308497434716,
"formula_full": "Zn2 Fe1 S3",
"formula_reduced": "Zn2FeS3",
"formula_anonymous": "AB2C3",
"energy_above_hull": 0.99655105,
"spacegroup": 156
},
{
"id": "jvasp-23545",
"created_at": "2022-09-04T14:37:39.860720Z",
"updated_at": "2022-09-04T14:37:39.860744Z",
"structure_string": "Tm4 In2 Pd4\n1.0\n7.684791 -0.000000 -0.000000\n-0.000000 7.684791 -0.000000\n-0.000000 0.000000 3.602905\nTm In Pd\n4 2 4\ndirect\n0.328718 0.828718 0.499999 Tm\n0.828718 0.671282 0.499999 Tm\n0.171282 0.328718 0.499999 Tm\n0.671282 0.171282 0.499999 Tm\n0.000000 0.000000 0.000000 In\n0.500000 0.500000 0.000000 In\n0.371086 0.128914 0.000000 Pd\n0.871086 0.371086 0.000000 Pd\n0.128914 0.628914 0.000000 Pd\n0.628914 0.871086 0.000000 Pd\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Tm",
"In",
"Pd"
],
"chemical_system": "In-Pd-Tm",
"density": 10.387892856406562,
"density_atomic": 0.04699839940441228,
"volume": 212.7732034861848,
"volume_molar": 12.813501813499276,
"formula_full": "Tm4 In2 Pd4",
"formula_reduced": "Tm2InPd2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 0.996755974,
"spacegroup": 127
},
{
"id": "jvasp-16245",
"created_at": "2022-09-04T14:38:00.421635Z",
"updated_at": "2022-09-04T14:38:00.421647Z",
"structure_string": "Pr2 Al2 Ge2\n1.0\n4.152541 -0.000000 -1.158470\n-0.323189 4.139945 -1.158470\n-0.009417 -0.010180 7.987878\nPr Al Ge\n2 2 2\ndirect\n0.333382 0.833384 0.666766 Pr\n0.583382 0.583384 0.166766 Pr\n0.917309 0.417310 0.834619 Al\n0.167309 0.167310 0.334619 Al\n0.000808 0.000808 0.001615 Ge\n0.750807 0.250808 0.501615 Ge\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Pr",
"Al",
"Ge"
],
"chemical_system": "Al-Ge-Pr",
"density": 5.821257816662686,
"density_atomic": 0.04372413284435916,
"volume": 137.22399072744696,
"volume_molar": 13.773036463493673,
"formula_full": "Pr2 Al2 Ge2",
"formula_reduced": "PrAlGe",
"formula_anonymous": "ABC",
"energy_above_hull": 0.9969595333333336,
"spacegroup": 109
},
{
"id": "jvasp-66228",
"created_at": "2022-09-04T14:36:10.048101Z",
"updated_at": "2022-09-04T14:36:10.048126Z",
"structure_string": "Ba4 In1 Os1\n1.0\n0.000000 4.782104 4.782104\n4.782104 0.000000 4.782104\n4.782104 4.782104 -0.000000\nBa In Os\n4 1 1\ndirect\n0.122261 0.625912 0.625912 Ba\n0.625912 0.625912 0.625912 Ba\n0.625912 0.122261 0.625912 Ba\n0.625912 0.625912 0.122261 Ba\n0.250000 0.250000 0.250000 In\n0.000000 0.000000 0.000000 Os\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"In",
"Os"
],
"chemical_system": "Ba-In-Os",
"density": 6.486358152596337,
"density_atomic": 0.027432425238336913,
"volume": 218.71926918131098,
"volume_molar": 21.952637098903082,
"formula_full": "Ba4 In1 Os1",
"formula_reduced": "Ba4InOs",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.997011475,
"spacegroup": 216
},
{
"id": "jvasp-65550",
"created_at": "2022-09-04T14:36:10.388959Z",
"updated_at": "2022-09-04T14:36:10.388978Z",
"structure_string": "Ba2 Cr1 In1\n1.0\n0.000000 4.192615 4.192615\n4.192615 -0.000000 4.192615\n4.192615 4.192615 -0.000000\nBa Cr In\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Ba\n0.750001 0.750001 0.750001 Ba\n0.000000 0.000000 0.000000 Cr\n0.500001 0.500001 0.500001 In\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"Cr",
"In"
],
"chemical_system": "Ba-Cr-In",
"density": 4.973515523960009,
"density_atomic": 0.027137825421753307,
"volume": 147.39574515774044,
"volume_molar": 22.190948119125036,
"formula_full": "Ba2 Cr1 In1",
"formula_reduced": "Ba2CrIn",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.9971273275,
"spacegroup": 225
},
{
"id": "jvasp-109378",
"created_at": "2022-09-04T14:38:26.852415Z",
"updated_at": "2022-09-04T14:38:26.852436Z",
"structure_string": "Na1 Sb1 S2\n1.0\n4.004799 0.000000 0.000000\n0.000000 4.004799 0.000000\n0.000000 -0.000000 5.442384\nNa Sb S\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Na\n0.500000 0.500000 0.500000 Sb\n0.000000 0.000000 0.500000 S\n0.500000 0.500000 -0.000000 S\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Na",
"Sb",
"S"
],
"chemical_system": "Na-S-Sb",
"density": 3.9736979084634174,
"density_atomic": 0.04582572689205921,
"volume": 87.28721334681391,
"volume_molar": 13.141397133066603,
"formula_full": "Na1 Sb1 S2",
"formula_reduced": "NaSbS2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.997426275,
"spacegroup": 123
},
{
"id": "jvasp-20232",
"created_at": "2022-09-04T14:37:54.265258Z",
"updated_at": "2022-09-04T14:37:54.265288Z",
"structure_string": "Na2 O4\n1.0\n3.391674 0.000000 0.000000\n0.000000 4.185196 0.000000\n0.000000 0.000000 5.613075\nNa O\n2 4\ndirect\n0.499999 0.500000 0.500000 Na\n0.000000 0.000000 0.000000 Na\n0.499999 0.385142 0.915127 O\n0.499999 0.614859 0.084872 O\n0.000000 0.114858 0.415128 O\n0.000000 0.885143 0.584871 O\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Na",
"O"
],
"chemical_system": "Na-O",
"density": 2.2920324625820276,
"density_atomic": 0.07530442581972413,
"volume": 79.67659184287211,
"volume_molar": 7.997060855914061,
"formula_full": "Na2 O4",
"formula_reduced": "NaO2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.9976017500000002,
"spacegroup": 58
}
]
}