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=-density&page=961",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-density&page=959",
"results": [
{
"id": "jvasp-106564",
"created_at": "2022-09-04T14:36:55.072426Z",
"updated_at": "2022-09-04T14:36:55.072452Z",
"structure_string": "Mg2 Pb4\n1.0\n3.523064 0.000000 0.000000\n-1.761532 3.051063 0.000000\n-0.000000 -0.000000 15.942069\nMg Pb\n2 4\ndirect\n0.000000 0.000000 0.341972 Mg\n0.000000 0.000000 0.658028 Mg\n0.333333 0.666666 0.814700 Pb\n0.000000 0.000000 0.000000 Pb\n0.333333 0.666666 0.185300 Pb\n0.333333 0.666666 0.500000 Pb\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Mg",
"Pb"
],
"chemical_system": "Mg-Pb",
"density": 8.502277683290194,
"density_atomic": 0.03501344617025646,
"volume": 171.3627379271491,
"volume_molar": 17.19950881360471,
"formula_full": "Mg2 Pb4",
"formula_reduced": "MgPb2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.186500492,
"spacegroup": 187
},
{
"id": "jvasp-75026",
"created_at": "2022-09-04T14:35:50.105972Z",
"updated_at": "2022-09-04T14:35:50.106001Z",
"structure_string": "Be1 Sn1 Bi2\n1.0\n-2.552309 2.552309 4.090164\n2.552309 -2.552309 4.090164\n2.552309 2.552309 -4.090164\nBe Sn Bi\n1 1 2\ndirect\n0.750000 0.250000 0.500000 Be\n0.250000 0.750000 0.500000 Sn\n0.000000 0.000000 0.000000 Bi\n0.499999 0.499999 0.000000 Bi\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Sn",
"Bi"
],
"chemical_system": "Be-Bi-Sn",
"density": 8.502023288870635,
"density_atomic": 0.0375312279817961,
"volume": 106.57791431551702,
"volume_molar": 16.045680047881564,
"formula_full": "Be1 Sn1 Bi2",
"formula_reduced": "BeSnBi2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.1500466,
"spacegroup": 139
},
{
"id": "jvasp-88449",
"created_at": "2022-09-04T14:36:01.829245Z",
"updated_at": "2022-09-04T14:36:01.829272Z",
"structure_string": "Cu4 Bi8 O16\n1.0\n5.997693 0.000000 0.000000\n-0.000000 8.429557 -0.000000\n-0.000000 -0.000000 8.429557\nCu Bi O\n4 8 16\ndirect\n0.424367 0.750000 0.750000 Cu\n0.575633 0.250000 0.250000 Cu\n0.924366 0.750000 0.750000 Cu\n0.075633 0.250000 0.250000 Cu\n0.750000 0.916744 0.416744 Bi\n0.750000 0.083256 0.916744 Bi\n0.250000 0.416744 0.916744 Bi\n0.750000 0.583257 0.083256 Bi\n0.250000 0.083256 0.583257 Bi\n0.250000 0.916744 0.083256 Bi\n0.250000 0.583257 0.416744 Bi\n0.750000 0.416744 0.583257 Bi\n0.091810 0.459570 0.151896 O\n0.408190 0.540430 0.651896 O\n0.408190 0.959570 0.848104 O\n0.091810 0.040430 0.348104 O\n0.091810 0.151896 0.040430 O\n0.091810 0.348104 0.459570 O\n0.591810 0.151896 0.459570 O\n0.908189 0.651896 0.540430 O\n0.591810 0.459570 0.348104 O\n0.591810 0.040430 0.151896 O\n0.908189 0.959570 0.651896 O\n0.908189 0.848104 0.959570 O\n0.408190 0.651896 0.959570 O\n0.908189 0.540430 0.848104 O\n0.591810 0.348104 0.040430 O\n0.408190 0.848104 0.540430 O\n",
"nsites": 28,
"nelements": 3,
"elements": [
"Cu",
"Bi",
"O"
],
"chemical_system": "Bi-Cu-O",
"density": 8.501853386499468,
"density_atomic": 0.06569983758600868,
"volume": 426.1806578036782,
"volume_molar": 9.166142537439795,
"formula_full": "Cu4 Bi8 O16",
"formula_reduced": "Cu(BiO2)2",
"formula_anonymous": "AB2C4",
"energy_above_hull": 1.626599007142857,
"spacegroup": 130
},
{
"id": "jvasp-14884",
"created_at": "2022-09-04T14:35:44.048959Z",
"updated_at": "2022-09-04T14:35:44.048980Z",
"structure_string": "Al2 Mo6\n1.0\n4.972868 -0.000000 0.000000\n0.000000 4.972868 0.000000\n-0.000000 0.000000 4.972868\nAl Mo\n2 6\ndirect\n0.000000 0.000000 0.000000 Al\n0.500000 0.500000 0.500000 Al\n0.250000 0.000000 0.500000 Mo\n0.750000 0.000000 0.500000 Mo\n0.000000 0.500000 0.250000 Mo\n0.000000 0.500000 0.750000 Mo\n0.500000 0.750000 0.000000 Mo\n0.500000 0.250000 0.000000 Mo\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Al",
"Mo"
],
"chemical_system": "Al-Mo",
"density": 8.501491894268995,
"density_atomic": 0.06505327909471606,
"volume": 122.97612220826235,
"volume_molar": 9.257243975713973,
"formula_full": "Al2 Mo6",
"formula_reduced": "AlMo3",
"formula_anonymous": "AB3",
"energy_above_hull": 4.848807625,
"spacegroup": 223
},
{
"id": "jvasp-69555",
"created_at": "2022-09-04T14:36:00.588477Z",
"updated_at": "2022-09-04T14:36:00.588505Z",
"structure_string": "Be2 Tl1 Ni1\n1.0\n2.898300 -0.000000 0.000000\n0.000000 2.898300 0.000000\n-0.000000 -0.000000 6.536371\nBe Tl Ni\n2 1 1\ndirect\n0.000000 0.000000 0.839887 Be\n0.000000 0.000000 0.160113 Be\n0.500000 0.500000 0.500000 Tl\n0.500000 0.500000 0.000000 Ni\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Tl",
"Ni"
],
"chemical_system": "Be-Ni-Tl",
"density": 8.501356310358164,
"density_atomic": 0.07285118546485969,
"volume": 54.906450382052185,
"volume_molar": 8.266359320816852,
"formula_full": "Be2 Tl1 Ni1",
"formula_reduced": "Be2TlNi",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.0711243,
"spacegroup": 123
},
{
"id": "jvasp-17782",
"created_at": "2022-09-04T14:38:08.644784Z",
"updated_at": "2022-09-04T14:38:08.644807Z",
"structure_string": "Tb1 In5 Rh1\n1.0\n4.659527 0.000000 -0.000000\n0.000000 4.659527 -0.000000\n0.000000 -0.000000 7.520581\nTb In Rh\n1 5 1\ndirect\n0.000000 0.000000 0.000000 Tb\n0.500000 0.500000 0.000000 In\n0.500000 0.000000 0.699377 In\n0.000000 0.500000 0.300622 In\n0.500000 0.000000 0.300622 In\n0.000000 0.500000 0.699377 In\n0.000000 0.000000 0.500000 Rh\n",
"nsites": 7,
"nelements": 3,
"elements": [
"Tb",
"In",
"Rh"
],
"chemical_system": "In-Rh-Tb",
"density": 8.501179706291333,
"density_atomic": 0.042870937582815065,
"volume": 163.2807770177149,
"volume_molar": 14.047140322897889,
"formula_full": "Tb1 In5 Rh1",
"formula_reduced": "TbIn5Rh",
"formula_anonymous": "ABC5",
"energy_above_hull": 0.2455558928571427,
"spacegroup": 123
},
{
"id": "jvasp-108046",
"created_at": "2022-09-04T14:38:18.993210Z",
"updated_at": "2022-09-04T14:38:18.993234Z",
"structure_string": "Yb2 Cd2 In2\n1.0\n4.909417 0.000000 0.000000\n-2.454710 4.251680 0.000000\n-0.000000 -0.000000 7.491622\nYb Cd In\n2 2 2\ndirect\n0.000000 0.000000 0.259773 Yb\n0.000000 0.000000 0.740227 Yb\n0.333333 0.666667 0.476624 Cd\n0.666667 0.333333 0.523375 Cd\n0.666667 0.333333 0.953069 In\n0.333333 0.666667 0.046931 In\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Yb",
"Cd",
"In"
],
"chemical_system": "Cd-In-Yb",
"density": 8.500895953927424,
"density_atomic": 0.03836939061357999,
"volume": 156.37464927254888,
"volume_molar": 15.695169153582016,
"formula_full": "Yb2 Cd2 In2",
"formula_reduced": "YbCdIn",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0,
"spacegroup": 164
},
{
"id": "jvasp-81125",
"created_at": "2022-09-04T14:37:18.039541Z",
"updated_at": "2022-09-04T14:37:18.039557Z",
"structure_string": "Mn1 Be1 Ru2\n1.0\n-10.420125 -0.000000 -6.016061\n-6.234258 -0.352183 -1.234072\n-5.385441 2.048635 -2.704267\nMn Be Ru\n1 1 2\ndirect\n0.500000 0.000001 0.000000 Mn\n0.000000 0.000000 0.000000 Be\n0.686388 0.000001 0.000000 Ru\n0.313611 0.000001 0.000000 Ru\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Mn",
"Be",
"Ru"
],
"chemical_system": "Be-Mn-Ru",
"density": 8.500773985535544,
"density_atomic": 0.07695563734857863,
"volume": 51.97799846529216,
"volume_molar": 7.825470579526335,
"formula_full": "Mn1 Be1 Ru2",
"formula_reduced": "MnBeRu2",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.896188585344828,
"spacegroup": 139
},
{
"id": "jvasp-106955",
"created_at": "2022-09-04T14:36:52.076454Z",
"updated_at": "2022-09-04T14:36:52.076474Z",
"structure_string": "La2 Ag1 Hg1\n1.0\n4.720632 -0.000000 2.725458\n1.573544 4.450655 2.725458\n-0.000000 -0.000000 5.450917\nLa Ag Hg\n2 1 1\ndirect\n0.749999 0.749999 0.750002 La\n0.250000 0.250000 0.250001 La\n0.500000 0.499999 0.500001 Ag\n0.000000 0.000000 0.000000 Hg\n",
"nsites": 4,
"nelements": 3,
"elements": [
"La",
"Ag",
"Hg"
],
"chemical_system": "Ag-Hg-La",
"density": 8.50065686957475,
"density_atomic": 0.03492740705317085,
"volume": 114.5232451384296,
"volume_molar": 17.24187756289022,
"formula_full": "La2 Ag1 Hg1",
"formula_reduced": "La2AgHg",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.350637965,
"spacegroup": 225
},
{
"id": "jvasp-8713",
"created_at": "2022-09-04T14:37:07.434660Z",
"updated_at": "2022-09-04T14:37:07.434672Z",
"structure_string": "Sc1 Ni1 Bi1\n1.0\n3.828106 -0.000000 2.210158\n1.276036 3.609173 2.210158\n0.000000 0.000000 4.420316\nSc Ni Bi\n1 1 1\ndirect\n0.500001 0.500000 0.500001 Sc\n0.250001 0.250000 0.250000 Ni\n0.000000 0.000000 0.000000 Bi\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Sc",
"Ni",
"Bi"
],
"chemical_system": "Bi-Ni-Sc",
"density": 8.500302398358032,
"density_atomic": 0.04912202736811641,
"volume": 61.072397878007926,
"volume_molar": 12.259552552402969,
"formula_full": "Sc1 Ni1 Bi1",
"formula_reduced": "ScNiBi",
"formula_anonymous": "ABC",
"energy_above_hull": 1.1206439833333333,
"spacegroup": 216
},
{
"id": "jvasp-107184",
"created_at": "2022-09-04T14:36:49.498528Z",
"updated_at": "2022-09-04T14:36:49.498548Z",
"structure_string": "K1 Pb3\n1.0\n5.053710 -0.000000 0.000000\n0.000000 5.053710 0.000000\n0.000000 0.000000 5.053710\nK Pb\n1 3\ndirect\n0.000000 0.000000 0.000000 K\n-0.000000 0.500000 0.500000 Pb\n0.500000 0.000000 0.500000 Pb\n0.500000 0.500000 -0.000000 Pb\n",
"nsites": 4,
"nelements": 2,
"elements": [
"K",
"Pb"
],
"chemical_system": "K-Pb",
"density": 8.50004717508789,
"density_atomic": 0.030990532636581195,
"volume": 129.0716764021798,
"volume_molar": 19.43219508557743,
"formula_full": "K1 Pb3",
"formula_reduced": "KPb3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.073860205,
"spacegroup": 221
},
{
"id": "jvasp-98994",
"created_at": "2022-09-04T14:36:03.946821Z",
"updated_at": "2022-09-04T14:36:03.946849Z",
"structure_string": "Nd4 Ge10 Rh6\n1.0\n5.729594 -0.041971 -2.126137\n-3.305182 7.790616 -0.275753\n-0.117865 0.056494 8.466221\nNd Ge Rh\n4 10 6\ndirect\n0.731625 0.598289 0.864868 Nd\n0.268375 0.401711 0.135132 Nd\n0.231626 0.864868 0.598289 Nd\n0.768375 0.135132 0.401711 Nd\n0.250000 0.223532 0.776468 Ge\n0.750000 0.776468 0.223532 Ge\n0.250000 0.499965 0.500036 Ge\n0.660184 0.258985 0.061560 Ge\n0.839817 0.938440 0.741015 Ge\n0.339817 0.741015 0.938440 Ge\n0.160184 0.061560 0.258985 Ge\n0.750000 0.500036 0.499965 Ge\n0.250001 0.776517 0.223483 Ge\n0.750000 0.223483 0.776517 Ge\n0.750000 0.000052 0.999947 Rh\n0.106563 0.466117 0.747135 Rh\n0.606563 0.747135 0.466117 Rh\n0.893437 0.533883 0.252865 Rh\n0.250001 0.999948 0.000053 Rh\n0.393438 0.252865 0.533883 Rh\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Nd",
"Ge",
"Rh"
],
"chemical_system": "Ge-Nd-Rh",
"density": 8.499491371928947,
"density_atomic": 0.0532956130779296,
"volume": 375.2654082570683,
"volume_molar": 11.29950555441466,
"formula_full": "Nd4 Ge10 Rh6",
"formula_reduced": "Nd2Ge5Rh3",
"formula_anonymous": "A2B3C5",
"energy_above_hull": 1.833365175,
"spacegroup": 72
}
]
}