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=-nelements&page=999",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-nelements&page=997",
"results": [
{
"id": "jvasp-8738",
"created_at": "2022-09-04T14:37:07.503155Z",
"updated_at": "2022-09-04T14:37:07.503182Z",
"structure_string": "Ba2 Cu2 Bi2\n1.0\n2.387573 -4.135399 0.000000\n2.387573 4.135399 -0.000000\n0.000000 0.000000 9.527497\nBa Cu Bi\n2 2 2\ndirect\n0.000000 0.000000 0.500000 Ba\n0.000000 0.000000 0.000000 Ba\n0.666666 0.333332 0.250000 Cu\n0.333332 0.666666 0.750000 Cu\n0.333332 0.666666 0.250000 Bi\n0.666666 0.333332 0.750000 Bi\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Cu",
"Bi"
],
"chemical_system": "Ba-Bi-Cu",
"density": 7.2347702083840035,
"density_atomic": 0.03189101608736157,
"volume": 188.14075987932551,
"volume_molar": 18.883502311444314,
"formula_full": "Ba2 Cu2 Bi2",
"formula_reduced": "BaCuBi",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0,
"spacegroup": 194
},
{
"id": "jvasp-34202",
"created_at": "2022-09-04T14:37:07.528342Z",
"updated_at": "2022-09-04T14:37:07.528364Z",
"structure_string": "Ca1 Sn1 O3\n1.0\n4.329319 0.000000 0.000000\n-0.000000 4.329319 0.000000\n-0.000000 -0.000000 4.329292\nCa Sn O\n1 1 3\ndirect\n0.500000 0.500000 0.500000 Ca\n0.000000 0.000000 0.000000 Sn\n0.500000 0.000000 0.500000 O\n0.000000 0.500000 0.500000 O\n0.500000 0.500000 0.000000 O\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Ca",
"Sn",
"O"
],
"chemical_system": "Ca-O-Sn",
"density": 4.231697318669015,
"density_atomic": 0.06161890134725158,
"volume": 81.14393296015847,
"volume_molar": 9.773203722121554,
"formula_full": "Ca1 Sn1 O3",
"formula_reduced": "CaSnO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.349724093333333,
"spacegroup": 221
},
{
"id": "jvasp-56907",
"created_at": "2022-09-04T14:37:07.538345Z",
"updated_at": "2022-09-04T14:37:07.538368Z",
"structure_string": "Tm2 Zr2 Sb2\n1.0\n4.117006 -0.000000 -1.039425\n-0.262424 4.108634 -1.039425\n0.015424 0.016440 8.734222\nTm Zr Sb\n2 2 2\ndirect\n0.324466 0.324466 0.648932 Tm\n0.675535 0.675533 0.351069 Tm\n0.500001 -0.000000 0.000000 Zr\n0.000000 0.500000 0.000000 Zr\n0.136304 0.136304 0.272609 Sb\n0.863697 0.863695 0.727392 Sb\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Tm",
"Zr",
"Sb"
],
"chemical_system": "Sb-Tm-Zr",
"density": 8.576949650060056,
"density_atomic": 0.04057276931252696,
"volume": 147.88243695624402,
"volume_molar": 14.842814188038792,
"formula_full": "Tm2 Zr2 Sb2",
"formula_reduced": "TmZrSb",
"formula_anonymous": "ABC",
"energy_above_hull": 1.8967482833333336,
"spacegroup": 139
},
{
"id": "jvasp-21232",
"created_at": "2022-09-04T14:37:07.540651Z",
"updated_at": "2022-09-04T14:37:07.540674Z",
"structure_string": "Nd4 Rh4 O12\n1.0\n5.379336 0.000000 0.000000\n-0.000000 5.879534 0.000000\n0.000000 0.000000 7.815947\nNd Rh O\n4 4 12\ndirect\n0.474288 0.577652 0.750000 Nd\n0.974288 0.922347 0.250000 Nd\n0.025713 0.077653 0.750000 Nd\n0.525713 0.422347 0.250000 Nd\n0.500000 0.000000 0.500000 Rh\n0.000000 0.500000 0.500000 Rh\n0.000000 0.500000 0.000000 Rh\n0.500000 0.000000 0.000000 Rh\n0.888347 0.464555 0.750000 O\n0.388347 0.035445 0.250000 O\n0.816572 0.195709 0.053238 O\n0.316571 0.304290 0.946762 O\n0.683429 0.695709 0.446762 O\n0.316571 0.304290 0.553238 O\n0.183429 0.804290 0.946762 O\n0.683429 0.695709 0.053238 O\n0.111654 0.535444 0.250000 O\n0.816572 0.195709 0.446762 O\n0.183429 0.804290 0.553238 O\n0.611654 0.964555 0.750000 O\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Nd",
"Rh",
"O"
],
"chemical_system": "Nd-O-Rh",
"density": 7.930350192179835,
"density_atomic": 0.08090527009186321,
"volume": 247.2026850326458,
"volume_molar": 7.443446827582692,
"formula_full": "Nd4 Rh4 O12",
"formula_reduced": "NdRhO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 2.040235,
"spacegroup": 62
},
{
"id": "jvasp-13113",
"created_at": "2022-09-04T14:37:07.546719Z",
"updated_at": "2022-09-04T14:37:07.546739Z",
"structure_string": "Tl4 Zn2 I8\n1.0\n0.000000 7.809705 -0.064539\n8.062050 0.000000 0.000000\n0.000000 -2.829790 -8.781700\nTl Zn I\n4 2 8\ndirect\n0.250871 0.027492 0.563785 Tl\n0.749128 0.527492 0.436216 Tl\n0.236150 0.017090 0.058406 Tl\n0.763849 0.517090 0.941594 Tl\n0.784341 0.972001 0.198610 Zn\n0.215658 0.472001 0.801390 Zn\n0.034406 0.736319 0.266573 I\n0.965593 0.236319 0.733427 I\n0.975596 0.246611 0.250131 I\n0.024403 0.746611 0.749869 I\n0.410572 0.447314 0.612500 I\n0.589427 0.947314 0.387500 I\n0.405274 0.440505 0.089063 I\n0.594725 0.940505 0.910937 I\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Tl",
"Zn",
"I"
],
"chemical_system": "I-Tl-Zn",
"density": 5.881465523638133,
"density_atomic": 0.025253079995472365,
"volume": 554.3878213077401,
"volume_molar": 23.847153539606698,
"formula_full": "Tl4 Zn2 I8",
"formula_reduced": "Tl2ZnI4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 0.0,
"spacegroup": 4
},
{
"id": "jvasp-52118",
"created_at": "2022-09-04T14:37:07.557498Z",
"updated_at": "2022-09-04T14:37:07.557518Z",
"structure_string": "Al4 Fe2 O8\n1.0\n5.017822 0.000000 2.897041\n1.672607 4.730848 2.897041\n-0.000000 -0.000000 5.794081\nAl Fe O\n4 2 8\ndirect\n0.500000 0.500000 0.500000 Al\n0.500000 0.500000 -0.000000 Al\n0.500000 0.000000 0.500000 Al\n0.000000 0.500000 0.500000 Al\n0.875000 0.875000 0.874999 Fe\n0.125000 0.125000 0.125000 Fe\n0.735006 0.735006 0.735005 O\n0.264994 0.264994 0.705017 O\n0.264994 0.705017 0.264994 O\n0.705017 0.264994 0.264994 O\n0.735006 0.294983 0.735006 O\n0.294983 0.735006 0.735005 O\n0.264994 0.264994 0.264994 O\n0.735006 0.735006 0.294983 O\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Al",
"Fe",
"O"
],
"chemical_system": "Al-Fe-O",
"density": 4.196664422738448,
"density_atomic": 0.10178627651562233,
"volume": 137.54309990749348,
"volume_molar": 5.91645648721192,
"formula_full": "Al4 Fe2 O8",
"formula_reduced": "Al2FeO4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 2.3037335857142853,
"spacegroup": 227
},
{
"id": "jvasp-50524",
"created_at": "2022-09-04T14:37:07.559982Z",
"updated_at": "2022-09-04T14:37:07.560009Z",
"structure_string": "Dy4 Al4 O12\n1.0\n5.204626 -0.000000 0.000000\n0.000000 5.359942 0.000000\n0.000000 0.000000 7.423482\nDy Al O\n4 4 12\ndirect\n0.012729 0.946427 0.750000 Dy\n0.487272 0.446427 0.750000 Dy\n0.512729 0.553573 0.250000 Dy\n0.987272 0.053573 0.250000 Dy\n0.000000 0.500000 0.000000 Al\n0.000000 0.500000 0.500000 Al\n0.500000 0.000000 0.000000 Al\n0.500000 0.000000 0.500000 Al\n0.794062 0.793555 0.045230 O\n0.705939 0.293555 0.454770 O\n0.705939 0.293555 0.045230 O\n0.585785 0.022292 0.750000 O\n0.414215 0.977708 0.250000 O\n0.205939 0.206445 0.545230 O\n0.294061 0.706444 0.545230 O\n0.205939 0.206445 0.954770 O\n0.794062 0.793555 0.454770 O\n0.085785 0.477708 0.250000 O\n0.294061 0.706444 0.954770 O\n0.914216 0.522292 0.750000 O\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Dy",
"Al",
"O"
],
"chemical_system": "Al-Dy-O",
"density": 7.616902106979917,
"density_atomic": 0.09657677941208866,
"volume": 207.0891172986927,
"volume_molar": 6.235599071184393,
"formula_full": "Dy4 Al4 O12",
"formula_reduced": "DyAlO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.4727579599999996,
"spacegroup": 62
},
{
"id": "jvasp-30282",
"created_at": "2022-09-04T14:37:07.561833Z",
"updated_at": "2022-09-04T14:37:07.561858Z",
"structure_string": "Ti1 Co3 O8\n1.0\n4.663688 1.376979 -2.506509\n1.617923 -5.479743 -0.000000\n1.617923 -2.501020 -4.875702\nTi Co O\n1 3 8\ndirect\n0.000000 0.000000 0.000000 Ti\n-0.000000 -0.000000 0.500000 Co\n-0.000000 0.500000 0.000000 Co\n-0.000000 0.500000 0.500000 Co\n0.220602 0.246693 0.026092 O\n0.220602 0.246693 0.506612 O\n0.220602 0.727213 0.026092 O\n0.212138 0.737380 0.525241 O\n0.787861 0.262619 0.474758 O\n0.779398 0.272786 0.973908 O\n0.779398 0.753306 0.493388 O\n0.779398 0.753306 0.973908 O\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Ti",
"Co",
"O"
],
"chemical_system": "Co-O-Ti",
"density": 4.7461861076701535,
"density_atomic": 0.0972564719143252,
"volume": 123.38510500947427,
"volume_molar": 6.19202058378696,
"formula_full": "Ti1 Co3 O8",
"formula_reduced": "TiCo3O8",
"formula_anonymous": "AB3C8",
"energy_above_hull": 3.231075752777778,
"spacegroup": 166
},
{
"id": "jvasp-21233",
"created_at": "2022-09-04T14:37:07.567134Z",
"updated_at": "2022-09-04T14:37:07.567169Z",
"structure_string": "Sr8 Pt2 O12\n1.0\n6.921696 0.008807 -0.014179\n-0.014227 6.921688 -0.014179\n0.008778 0.008807 6.921706\nSr Pt O\n8 2 12\ndirect\n0.250000 0.250000 0.250000 Sr\n0.750000 0.750001 0.750000 Sr\n0.617677 0.882324 0.250000 Sr\n0.250000 0.617678 0.882323 Sr\n0.882323 0.250001 0.617677 Sr\n0.382323 0.117678 0.750000 Sr\n0.750000 0.382323 0.117677 Sr\n0.117677 0.750000 0.382323 Sr\n0.000000 0.000000 0.000000 Pt\n0.500000 0.500001 0.500000 Pt\n0.072908 0.286851 0.941863 O\n0.786851 0.572909 0.441862 O\n0.558138 0.213149 0.427092 O\n0.427092 0.558138 0.213149 O\n0.213149 0.427092 0.558138 O\n0.713150 0.058138 0.927092 O\n0.927092 0.713150 0.058138 O\n0.058137 0.927092 0.713149 O\n0.441862 0.786852 0.572908 O\n0.572908 0.441863 0.786851 O\n0.941863 0.072909 0.286851 O\n0.286851 0.941863 0.072908 O\n",
"nsites": 22,
"nelements": 3,
"elements": [
"Sr",
"Pt",
"O"
],
"chemical_system": "O-Pt-Sr",
"density": 6.425035869831031,
"density_atomic": 0.06634093602176362,
"volume": 331.6202833312865,
"volume_molar": 9.077563750418586,
"formula_full": "Sr8 Pt2 O12",
"formula_reduced": "Sr4PtO6",
"formula_anonymous": "AB4C6",
"energy_above_hull": 1.4028452399999998,
"spacegroup": 167
},
{
"id": "jvasp-9736",
"created_at": "2022-09-04T14:37:11.629725Z",
"updated_at": "2022-09-04T14:37:11.629736Z",
"structure_string": "Cu6 P2 Se8\n1.0\n6.452536 0.000000 0.000000\n0.000000 6.739770 0.000000\n0.000000 0.000000 7.761488\nCu P Se\n6 2 8\ndirect\n0.009665 0.823470 0.253817 Cu\n0.509665 0.176530 0.246183 Cu\n0.509665 0.176530 0.753817 Cu\n0.009665 0.823470 0.746184 Cu\n0.997709 0.345736 0.000000 Cu\n0.497708 0.654264 0.500000 Cu\n0.499869 0.672218 0.000000 P\n-0.000131 0.327782 0.500000 P\n0.357657 0.321206 0.500000 Se\n0.857657 0.678794 0.000000 Se\n0.874616 0.646463 0.500000 Se\n0.374615 0.353537 0.000000 Se\n0.382051 0.837030 0.243460 Se\n0.882051 0.162970 0.256540 Se\n0.882051 0.162970 0.743461 Se\n0.382051 0.837030 0.756540 Se\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Cu",
"P",
"Se"
],
"chemical_system": "Cu-P-Se",
"density": 5.288080788066403,
"density_atomic": 0.047402307136903965,
"volume": 337.5363134496796,
"volume_molar": 12.704319945034074,
"formula_full": "Cu6 P2 Se8",
"formula_reduced": "Cu3PSe4",
"formula_anonymous": "AB3C4",
"energy_above_hull": 1.0415837895833333,
"spacegroup": 31
},
{
"id": "jvasp-79088",
"created_at": "2022-09-04T14:37:11.766132Z",
"updated_at": "2022-09-04T14:37:11.766156Z",
"structure_string": "Tb1 Ag1 Hg2\n1.0\n0.000000 3.537806 3.537806\n3.537806 0.000000 3.537806\n3.537806 3.537806 0.000000\nTb Ag Hg\n1 1 2\ndirect\n0.750002 0.750002 0.750002 Tb\n0.250000 0.250000 0.250000 Ag\n0.000000 0.000000 0.000000 Hg\n0.500000 0.500000 0.500000 Hg\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Tb",
"Ag",
"Hg"
],
"chemical_system": "Ag-Hg-Tb",
"density": 12.524959356391644,
"density_atomic": 0.04516769760331707,
"volume": 88.5588642381064,
"volume_molar": 13.33284864969017,
"formula_full": "Tb1 Ag1 Hg2",
"formula_reduced": "TbAgHg2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-85014",
"created_at": "2022-09-04T14:37:11.768082Z",
"updated_at": "2022-09-04T14:37:11.768111Z",
"structure_string": "Tl3 V1 Se4\n1.0\n-3.903118 -3.903118 3.903118\n-3.903118 3.903118 -3.903118\n3.903118 -3.903118 -3.903118\nTl V Se\n3 1 4\ndirect\n0.000000 0.500000 0.500000 Tl\n0.500000 0.000000 0.500000 Tl\n0.500000 0.500000 0.000000 Tl\n0.000000 0.000000 0.000000 V\n0.340055 0.000000 0.000000 Se\n0.000000 0.340055 0.000000 Se\n0.000000 0.000000 0.340055 Se\n0.659946 0.659946 0.659946 Se\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Tl",
"V",
"Se"
],
"chemical_system": "Se-Tl-V",
"density": 6.841474879004856,
"density_atomic": 0.03363527262549944,
"volume": 237.84555246729508,
"volume_molar": 17.904242451225205,
"formula_full": "Tl3 V1 Se4",
"formula_reduced": "Tl3VSe4",
"formula_anonymous": "AB3C4",
"energy_above_hull": 1.0929769333333337,
"spacegroup": 217
}
]
}