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=updated_at&page=357",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=updated_at&page=355",
"results": [
{
"id": "jvasp-64955",
"created_at": "2022-09-04T14:35:52.451490Z",
"updated_at": "2022-09-04T14:35:52.451517Z",
"structure_string": "Zr1 Be1 Cd1\n1.0\n0.000000 3.201813 3.201813\n3.201813 0.000000 3.201813\n3.201813 3.201813 0.000000\nZr Be Cd\n1 1 1\ndirect\n0.749999 0.749999 0.749999 Zr\n0.000000 0.000000 0.000000 Be\n0.500000 0.500000 0.500000 Cd\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Zr",
"Be",
"Cd"
],
"chemical_system": "Be-Cd-Zr",
"density": 5.378867457140825,
"density_atomic": 0.04569864974859541,
"volume": 65.64745384172336,
"volume_molar": 13.177940252348696,
"formula_full": "Zr1 Be1 Cd1",
"formula_reduced": "ZrBeCd",
"formula_anonymous": "ABC",
"energy_above_hull": 1.4957701166666664,
"spacegroup": 216
},
{
"id": "jvasp-63245",
"created_at": "2022-09-04T14:35:52.454247Z",
"updated_at": "2022-09-04T14:35:52.454272Z",
"structure_string": "K2 Be4 B6 O14\n1.0\n4.527936 5.229495 -0.019193\n-4.527936 5.229495 -0.019193\n0.000000 2.717833 5.893045\nK Be B O\n2 4 6 14\ndirect\n0.821567 0.178431 0.250000 K\n0.178431 0.821567 0.750000 K\n0.635333 0.057355 0.841558 Be\n0.942644 0.364666 0.658441 Be\n0.057355 0.635333 0.341559 Be\n0.364666 0.942644 0.158442 Be\n0.451428 0.548570 0.250000 B\n0.733821 0.770048 0.182114 B\n0.770048 0.733821 0.682113 B\n0.266178 0.229950 0.817886 B\n0.548570 0.451428 0.750000 B\n0.229951 0.266178 0.317887 B\n0.579912 0.649442 0.734086 O\n0.778581 0.922447 0.693102 O\n0.077552 0.221418 0.806898 O\n0.420087 0.350557 0.265914 O\n0.649442 0.579912 0.234087 O\n0.350557 0.420087 0.765913 O\n0.299478 0.700520 0.250000 O\n0.613558 0.943291 0.118535 O\n0.943291 0.613558 0.618535 O\n0.386441 0.056708 0.881465 O\n0.700520 0.299478 0.750000 O\n0.922447 0.778581 0.193103 O\n0.056708 0.386441 0.381465 O\n0.221418 0.077552 0.306898 O\n",
"nsites": 26,
"nelements": 4,
"elements": [
"K",
"Be",
"B",
"O"
],
"chemical_system": "B-Be-K-O",
"density": 2.3944224730033854,
"density_atomic": 0.09300559548012913,
"volume": 279.5530727563049,
"volume_molar": 6.4750305924191895,
"formula_full": "K2 Be4 B6 O14",
"formula_reduced": "KBe2B3O7",
"formula_anonymous": "AB2C3D7",
"energy_above_hull": 2.915134034615385,
"spacegroup": 15
},
{
"id": "jvasp-12154",
"created_at": "2022-09-04T14:35:52.458263Z",
"updated_at": "2022-09-04T14:35:52.458292Z",
"structure_string": "V2 Ag2 P4 S12\n1.0\n5.903480 0.045983 0.000000\n-1.871217 6.453409 0.000000\n0.000000 0.000000 10.767942\nV Ag P S\n2 2 4 12\ndirect\n0.750000 -0.000000 0.928928 V\n0.250000 -0.000000 0.071071 V\n0.250000 -0.000000 0.435723 Ag\n0.750000 -0.000000 0.564277 Ag\n0.295659 0.172965 0.750788 P\n0.204340 0.827035 0.750788 P\n0.704340 0.827035 0.249212 P\n0.795659 0.172965 0.249212 P\n0.519893 0.711696 0.398504 S\n0.980328 0.238620 0.770652 S\n0.519671 0.761380 0.770652 S\n0.019893 0.711696 0.601496 S\n0.019671 0.761380 0.229348 S\n0.508603 0.766264 0.080000 S\n0.008603 0.766264 0.920000 S\n0.491397 0.233736 0.920000 S\n0.480107 0.288304 0.601496 S\n0.980106 0.288304 0.398504 S\n0.991397 0.233736 0.080000 S\n0.480328 0.238620 0.229348 S\n",
"nsites": 20,
"nelements": 4,
"elements": [
"V",
"Ag",
"P",
"S"
],
"chemical_system": "Ag-P-S-V",
"density": 3.33713810925608,
"density_atomic": 0.04864298794476559,
"volume": 411.15895312002874,
"volume_molar": 12.380285452115272,
"formula_full": "V2 Ag2 P4 S12",
"formula_reduced": "VAg(PS3)2",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 2.521937246,
"spacegroup": 13
},
{
"id": "jvasp-105628",
"created_at": "2022-09-04T14:35:52.459768Z",
"updated_at": "2022-09-04T14:35:52.459795Z",
"structure_string": "K3 Sc1 I6\n1.0\n7.473072 0.000000 4.314580\n2.491024 7.045680 4.314580\n0.000000 -0.000000 8.629161\nK Sc I\n3 1 6\ndirect\n0.749999 0.750000 0.750000 K\n0.250000 0.250000 0.250000 K\n0.500000 0.500000 0.500000 K\n0.000000 0.000000 0.000000 Sc\n0.765674 0.234326 0.234326 I\n0.234325 0.234326 0.765674 I\n0.234325 0.765674 0.765675 I\n0.234325 0.765674 0.234326 I\n0.765674 0.234326 0.765675 I\n0.765674 0.765674 0.234326 I\n",
"nsites": 10,
"nelements": 3,
"elements": [
"K",
"Sc",
"I"
],
"chemical_system": "I-K-Sc",
"density": 3.375816807963525,
"density_atomic": 0.02200945795400156,
"volume": 454.3501262456984,
"volume_molar": 27.36160414575366,
"formula_full": "K3 Sc1 I6",
"formula_reduced": "K3ScI6",
"formula_anonymous": "AB3C6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-70888",
"created_at": "2022-09-04T14:35:52.461011Z",
"updated_at": "2022-09-04T14:35:52.461021Z",
"structure_string": "Na1 Be1 Pd2\n1.0\n3.091495 0.000000 -0.000000\n0.000000 3.091495 0.000000\n0.000000 0.000000 6.774505\nNa Be Pd\n1 1 2\ndirect\n0.500001 0.500001 0.748011 Na\n0.000000 0.000000 0.397068 Be\n0.000000 0.000000 0.044411 Pd\n0.500001 0.500001 0.310509 Pd\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Na",
"Be",
"Pd"
],
"chemical_system": "Be-Na-Pd",
"density": 6.27943059894236,
"density_atomic": 0.061779633391835745,
"volume": 64.74625666083355,
"volume_molar": 9.74777678236568,
"formula_full": "Na1 Be1 Pd2",
"formula_reduced": "NaBePd2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.0717616250000002,
"spacegroup": 99
},
{
"id": "jvasp-63339",
"created_at": "2022-09-04T14:35:52.469600Z",
"updated_at": "2022-09-04T14:35:52.469626Z",
"structure_string": "Tb10 Ge6 B2\n1.0\n4.313912 -7.471915 -0.000000\n4.313912 7.471915 0.000000\n-0.000000 0.000000 6.410469\nTb Ge B\n10 6 2\ndirect\n0.666667 0.333333 0.000000 Tb\n0.000000 0.762328 0.250000 Tb\n0.762328 0.000000 0.250000 Tb\n0.000000 0.237671 0.750000 Tb\n0.762328 0.762328 0.750000 Tb\n0.237671 0.237671 0.250000 Tb\n0.666667 0.333333 0.500000 Tb\n0.333333 0.666667 0.000000 Tb\n0.333333 0.666667 0.500000 Tb\n0.237671 0.000000 0.750000 Tb\n0.600427 0.000000 0.750000 Ge\n0.399572 0.399572 0.750000 Ge\n0.000000 0.600427 0.750000 Ge\n0.399572 0.000000 0.250000 Ge\n0.600427 0.600427 0.250000 Ge\n0.000000 0.399572 0.250000 Ge\n0.000000 0.000000 0.000000 B\n0.000000 0.000000 0.500000 B\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Tb",
"Ge",
"B"
],
"chemical_system": "B-Ge-Tb",
"density": 8.224008899358427,
"density_atomic": 0.04355615159849023,
"volume": 413.25965080496064,
"volume_molar": 13.826154375421781,
"formula_full": "Tb10 Ge6 B2",
"formula_reduced": "Tb5Ge3B",
"formula_anonymous": "AB3C5",
"energy_above_hull": 1.769389159259259,
"spacegroup": 193
},
{
"id": "jvasp-66457",
"created_at": "2022-09-04T14:35:52.474624Z",
"updated_at": "2022-09-04T14:35:52.474650Z",
"structure_string": "Ba4 Sc1 Os1\n1.0\n-0.000000 4.778864 4.778864\n4.778864 -0.000000 4.778864\n4.778864 4.778864 -0.000000\nBa Sc Os\n4 1 1\ndirect\n0.128159 0.623947 0.623947 Ba\n0.623947 0.623947 0.623947 Ba\n0.623947 0.128159 0.623947 Ba\n0.623947 0.623947 0.128159 Ba\n0.000000 0.000000 0.000000 Sc\n0.250000 0.250000 0.250000 Os\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Sc",
"Os"
],
"chemical_system": "Ba-Os-Sc",
"density": 5.968080406381154,
"density_atomic": 0.027488259427037306,
"volume": 218.27500631409322,
"volume_molar": 21.908046873555968,
"formula_full": "Ba4 Sc1 Os1",
"formula_reduced": "Ba4ScOs",
"formula_anonymous": "ABC4",
"energy_above_hull": 1.6118390216666665,
"spacegroup": 216
},
{
"id": "jvasp-14626",
"created_at": "2022-09-04T14:35:52.475164Z",
"updated_at": "2022-09-04T14:35:52.475189Z",
"structure_string": "Tb2\n1.0\n1.787845 -3.096639 -0.000000\n1.787845 3.096639 -0.000000\n-0.000000 0.000000 5.638191\nTb\n2\ndirect\n0.333334 0.666668 0.750000 Tb\n0.666668 0.333334 0.250000 Tb\n",
"nsites": 2,
"nelements": 1,
"elements": [
"Tb"
],
"chemical_system": "Tb",
"density": 8.454385497875014,
"density_atomic": 0.03203610973648989,
"volume": 62.429552665751814,
"volume_molar": 18.79797768684953,
"formula_full": "Tb2",
"formula_reduced": "Tb",
"formula_anonymous": "A",
"energy_above_hull": 0.0159599999999999,
"spacegroup": 194
},
{
"id": "jvasp-65071",
"created_at": "2022-09-04T14:35:52.475861Z",
"updated_at": "2022-09-04T14:35:52.475885Z",
"structure_string": "Na1 Be1 Br4\n1.0\n0.000000 4.541971 4.541971\n4.541971 0.000000 4.541971\n4.541971 4.541971 -0.000000\nNa Be Br\n1 1 4\ndirect\n0.250000 0.250000 0.250000 Na\n0.000000 0.000000 0.000000 Be\n0.123529 0.625490 0.625490 Br\n0.625490 0.625490 0.625490 Br\n0.625490 0.123529 0.625490 Br\n0.625490 0.625490 0.123529 Br\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Na",
"Be",
"Br"
],
"chemical_system": "Be-Br-Na",
"density": 3.115710300402314,
"density_atomic": 0.03201755644372196,
"volume": 187.3971866199829,
"volume_molar": 18.808870597558762,
"formula_full": "Na1 Be1 Br4",
"formula_reduced": "NaBeBr4",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.2045119199999999,
"spacegroup": 216
},
{
"id": "jvasp-68236",
"created_at": "2022-09-04T14:35:52.477428Z",
"updated_at": "2022-09-04T14:35:52.477439Z",
"structure_string": "Be1 Cu1 Rh2\n1.0\n-1.810284 1.810284 3.788571\n1.810284 -1.810284 3.788571\n1.810284 1.810284 -3.788571\nBe Cu Rh\n1 1 2\ndirect\n0.500000 0.500000 0.000000 Be\n0.749999 0.250000 0.499999 Cu\n0.000000 0.000000 0.000000 Rh\n0.250000 0.749999 0.499999 Rh\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Cu",
"Rh"
],
"chemical_system": "Be-Cu-Rh",
"density": 9.30767912403676,
"density_atomic": 0.08054361973622969,
"volume": 49.662530850978655,
"volume_molar": 7.476868782060901,
"formula_full": "Be1 Cu1 Rh2",
"formula_reduced": "BeCuRh2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.7846306375,
"spacegroup": 119
},
{
"id": "jvasp-87957",
"created_at": "2022-09-04T14:35:52.480567Z",
"updated_at": "2022-09-04T14:35:52.480585Z",
"structure_string": "Tl8 Hg2 I12\n1.0\n9.305157 -0.000000 0.000000\n-0.000000 9.440187 0.000000\n0.000000 0.000000 9.440187\nTl Hg I\n8 2 12\ndirect\n0.250000 0.351978 0.851978 Tl\n0.250000 0.851978 0.648023 Tl\n0.250000 0.648023 0.148022 Tl\n0.750000 0.648023 0.148022 Tl\n0.750000 0.851978 0.648023 Tl\n0.750000 0.148022 0.351978 Tl\n0.750000 0.351978 0.851978 Tl\n0.250000 0.148022 0.351978 Tl\n0.000000 0.000000 0.000000 Hg\n0.500000 0.500000 0.500000 Hg\n0.204468 0.500000 0.500000 I\n0.500000 0.358365 0.171488 I\n0.795532 0.500000 0.500000 I\n0.000000 0.328513 0.141635 I\n0.000000 0.858365 0.328513 I\n0.000000 0.141635 0.671488 I\n0.000000 0.671488 0.858365 I\n0.500000 0.828513 0.358365 I\n0.500000 0.171488 0.641636 I\n0.500000 0.641636 0.828513 I\n0.704468 0.000000 0.000000 I\n0.295532 0.000000 0.000000 I\n",
"nsites": 22,
"nelements": 3,
"elements": [
"Tl",
"Hg",
"I"
],
"chemical_system": "Hg-I-Tl",
"density": 7.126961179444861,
"density_atomic": 0.026530032446828958,
"volume": 829.2488915756899,
"volume_molar": 22.69933431883083,
"formula_full": "Tl8 Hg2 I12",
"formula_reduced": "Tl4HgI6",
"formula_anonymous": "AB4C6",
"energy_above_hull": 0.0,
"spacegroup": 128
},
{
"id": "jvasp-75519",
"created_at": "2022-09-04T14:35:52.488305Z",
"updated_at": "2022-09-04T14:35:52.488329Z",
"structure_string": "Cu1 As1 Pt2\n1.0\n-0.000000 3.147004 3.147004\n3.147004 0.000000 3.147004\n3.147004 3.147004 -0.000000\nCu As Pt\n1 1 2\ndirect\n0.250000 0.250000 0.250000 Cu\n0.499999 0.499999 0.499999 As\n0.000000 0.000000 0.000000 Pt\n0.749999 0.749999 0.749999 Pt\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Cu",
"As",
"Pt"
],
"chemical_system": "As-Cu-Pt",
"density": 14.082625284599853,
"density_atomic": 0.06417089712724837,
"volume": 62.333552732918115,
"volume_molar": 9.38453571571289,
"formula_full": "Cu1 As1 Pt2",
"formula_reduced": "CuAsPt2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.7951612499999998,
"spacegroup": 216
}
]
}