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=1559",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=energy_above_hull&page=1557",
"results": [
{
"id": "jvasp-97646",
"created_at": "2022-09-04T14:36:16.784520Z",
"updated_at": "2022-09-04T14:36:16.784544Z",
"structure_string": "Ce2 Te6\n1.0\n4.377101 0.000000 -0.736994\n0.000000 4.440344 0.000000\n-0.050992 0.000000 13.063734\nCe Te\n2 6\ndirect\n0.088870 0.749999 0.336007 Ce\n0.752864 0.250000 0.663993 Ce\n0.993085 0.250000 0.144398 Te\n0.493313 0.749999 0.144858 Te\n0.624903 0.250000 0.408080 Te\n0.848687 0.749999 0.855602 Te\n0.348456 0.250000 0.855142 Te\n0.216823 0.749999 0.591920 Te\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Ce",
"Te"
],
"chemical_system": "Ce-Te",
"density": 6.844252632416048,
"density_atomic": 0.031528622389564456,
"volume": 253.73769589907266,
"volume_molar": 19.100551510278628,
"formula_full": "Ce2 Te6",
"formula_reduced": "CeTe3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.9688797000000002,
"spacegroup": 63
},
{
"id": "jvasp-15532",
"created_at": "2022-09-04T14:35:43.606909Z",
"updated_at": "2022-09-04T14:35:43.606930Z",
"structure_string": "Sm1 Ni2 Ge2\n1.0\n3.841259 0.000000 -1.478588\n-0.569143 3.798861 -1.478588\n-0.007344 -0.008527 5.709862\nSm Ni Ge\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Sm\n0.750001 0.249999 0.500000 Ni\n0.250001 0.749999 0.500000 Ni\n0.630602 0.630600 0.261200 Ge\n0.369400 0.369399 0.738799 Ge\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Sm",
"Ni",
"Ge"
],
"chemical_system": "Ge-Ni-Sm",
"density": 8.240999116437749,
"density_atomic": 0.060078978772532786,
"volume": 83.22378479385748,
"volume_molar": 10.023706932171148,
"formula_full": "Sm1 Ni2 Ge2",
"formula_reduced": "Sm(NiGe)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 0.968893115,
"spacegroup": 139
},
{
"id": "jvasp-15783",
"created_at": "2022-09-04T14:35:45.835339Z",
"updated_at": "2022-09-04T14:35:45.835359Z",
"structure_string": "Ca2 Ga2 N2\n1.0\n3.580103 0.000000 0.000000\n0.000000 3.580103 -0.000000\n0.000000 0.000000 7.527258\nCa Ga N\n2 2 2\ndirect\n0.000000 0.500000 0.648585 Ca\n0.500000 0.000000 0.351415 Ca\n0.500000 0.000000 0.918819 Ga\n0.000000 0.500000 0.081181 Ga\n0.500000 0.000000 0.671164 N\n0.000000 0.500000 0.328837 N\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ca",
"Ga",
"N"
],
"chemical_system": "Ca-Ga-N",
"density": 4.261857297389975,
"density_atomic": 0.06219040791352652,
"volume": 96.47790071328652,
"volume_molar": 9.683391638745263,
"formula_full": "Ca2 Ga2 N2",
"formula_reduced": "CaGaN",
"formula_anonymous": "ABC",
"energy_above_hull": 0.9688953316666662,
"spacegroup": 129
},
{
"id": "jvasp-95420",
"created_at": "2022-09-04T14:36:07.061710Z",
"updated_at": "2022-09-04T14:36:07.061730Z",
"structure_string": "Na8 Te4 O12\n1.0\n4.938864 0.003702 0.000000\n-0.193363 6.864796 0.000000\n0.000000 0.000000 10.243247\nNa Te O\n8 4 12\ndirect\n0.744313 0.902732 0.253855 Na\n0.255688 0.597269 0.753856 Na\n0.255687 0.097268 0.746145 Na\n0.744312 0.402731 0.246145 Na\n0.246105 0.138373 0.413423 Na\n0.753894 0.361627 0.913423 Na\n0.753895 0.861628 0.586578 Na\n0.246105 0.638373 0.086578 Na\n0.261038 0.164196 0.082551 Te\n0.738962 0.835804 0.917449 Te\n0.738962 0.335804 0.582551 Te\n0.261038 0.664196 0.417449 Te\n0.353632 0.853490 0.906166 O\n0.231573 0.353887 0.219079 O\n0.768427 0.146113 0.719079 O\n0.768427 0.646113 0.780921 O\n0.231573 0.853887 0.280921 O\n0.752086 0.163151 0.436548 O\n0.247913 0.336849 0.936548 O\n0.247913 0.836849 0.563453 O\n0.752087 0.663151 0.063452 O\n0.646368 0.146510 0.093835 O\n0.353631 0.353490 0.593835 O\n0.646368 0.646510 0.406166 O\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Na",
"Te",
"O"
],
"chemical_system": "Na-O-Te",
"density": 4.237734038323906,
"density_atomic": 0.06910504021812247,
"volume": 347.2973885008479,
"volume_molar": 8.714473996385465,
"formula_full": "Na8 Te4 O12",
"formula_reduced": "Na2TeO3",
"formula_anonymous": "AB2C3",
"energy_above_hull": 0.968949377777778,
"spacegroup": 14
},
{
"id": "jvasp-106332",
"created_at": "2022-09-04T14:37:48.699404Z",
"updated_at": "2022-09-04T14:37:48.699423Z",
"structure_string": "Sn1 Pb1 S2\n1.0\n4.007153 -0.000629 6.045707\n1.821201 3.569384 6.045707\n-0.001027 -0.000629 7.253126\nSn Pb S\n1 1 2\ndirect\n0.500000 0.499999 0.500002 Sn\n0.000000 0.000000 0.000000 Pb\n0.247560 0.247560 0.247561 S\n0.752439 0.752438 0.752442 S\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sn",
"Pb",
"S"
],
"chemical_system": "Pb-S-Sn",
"density": 6.240817473552685,
"density_atomic": 0.03854279693999565,
"volume": 103.78074030868325,
"volume_molar": 15.624555657897409,
"formula_full": "Sn1 Pb1 S2",
"formula_reduced": "SnPbS2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.96900313,
"spacegroup": 166
},
{
"id": "jvasp-100302",
"created_at": "2022-09-04T14:36:59.093508Z",
"updated_at": "2022-09-04T14:36:59.093533Z",
"structure_string": "Tb1 Al3 Cu2\n1.0\n5.363254 0.000000 -0.000000\n-2.681628 4.644713 0.000000\n0.000000 -0.000000 4.053568\nTb Al Cu\n1 3 2\ndirect\n0.000000 0.000000 0.000000 Tb\n0.500000 -0.000000 0.500000 Al\n-0.000000 0.500000 0.500000 Al\n0.499999 0.500000 0.500000 Al\n0.333332 0.666667 0.000000 Cu\n0.666666 0.333333 0.000000 Cu\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Tb",
"Al",
"Cu"
],
"chemical_system": "Al-Cu-Tb",
"density": 6.034557629164022,
"density_atomic": 0.059419164164042,
"volume": 100.97752273046866,
"volume_molar": 10.135014257983029,
"formula_full": "Tb1 Al3 Cu2",
"formula_reduced": "TbAl3Cu2",
"formula_anonymous": "AB2C3",
"energy_above_hull": 0.9690812833333337,
"spacegroup": 191
},
{
"id": "jvasp-70817",
"created_at": "2022-09-04T14:35:45.791622Z",
"updated_at": "2022-09-04T14:35:45.791643Z",
"structure_string": "Be1 In1 Se2\n1.0\n3.770387 0.000000 0.000000\n0.000000 3.770387 0.000000\n-0.000000 0.000000 6.181594\nBe In Se\n1 1 2\ndirect\n0.000000 0.000000 0.315944 Be\n0.500000 0.500000 0.832719 In\n0.000000 0.000000 0.956976 Se\n0.500000 0.500000 0.394359 Se\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"In",
"Se"
],
"chemical_system": "Be-In-Se",
"density": 5.324035790605465,
"density_atomic": 0.04551846990946606,
"volume": 87.87641605607126,
"volume_molar": 13.23010367434963,
"formula_full": "Be1 In1 Se2",
"formula_reduced": "BeInSe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.9691432008333336,
"spacegroup": 99
},
{
"id": "jvasp-40457",
"created_at": "2022-09-04T14:38:06.275244Z",
"updated_at": "2022-09-04T14:38:06.275266Z",
"structure_string": "Th1 Pb1 Au2\n1.0\n-0.000042 3.643378 3.643377\n3.643249 -0.000021 3.643355\n3.643245 3.643352 -0.000016\nTh Pb Au\n1 1 2\ndirect\n0.750002 0.750001 0.750000 Th\n0.250000 0.250000 0.250000 Pb\n0.500000 0.500002 0.500002 Au\n0.000003 0.999999 0.999998 Au\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Th",
"Pb",
"Au"
],
"chemical_system": "Au-Pb-Th",
"density": 14.303902546308002,
"density_atomic": 0.04135530118551092,
"volume": 96.72278729290028,
"volume_molar": 14.561955994434621,
"formula_full": "Th1 Pb1 Au2",
"formula_reduced": "ThPbAu2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.9691953900000002,
"spacegroup": 225
},
{
"id": "jvasp-2319",
"created_at": "2022-09-04T14:36:38.405851Z",
"updated_at": "2022-09-04T14:36:38.405874Z",
"structure_string": "Ba2 Pd2 S4\n1.0\n5.643232 0.000000 0.000000\n0.000000 5.763369 -2.699934\n0.000000 -0.018411 6.364411\nBa Pd S\n2 2 4\ndirect\n0.750000 0.349410 0.650591 Ba\n0.250000 0.650591 0.349410 Ba\n0.500000 0.000000 0.000000 Pd\n0.000000 0.000000 0.000000 Pd\n0.750000 0.858684 0.664518 S\n0.250000 0.141317 0.335482 S\n0.750000 0.335482 0.141317 S\n0.250000 0.664518 0.858684 S\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Ba",
"Pd",
"S"
],
"chemical_system": "Ba-Pd-S",
"density": 4.946325987953769,
"density_atomic": 0.038700482796178444,
"volume": 206.71576740096833,
"volume_molar": 15.560893107500634,
"formula_full": "Ba2 Pd2 S4",
"formula_reduced": "BaPdS2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.9693854175,
"spacegroup": 63
},
{
"id": "jvasp-105881",
"created_at": "2022-09-04T14:36:20.350650Z",
"updated_at": "2022-09-04T14:36:20.350672Z",
"structure_string": "Y2 Mg1 Hg1\n1.0\n4.566192 0.000000 2.636292\n1.522064 4.305046 2.636292\n-0.000000 -0.000000 5.272583\nY Mg Hg\n2 1 1\ndirect\n0.749999 0.750001 0.749999 Y\n0.250000 0.250000 0.250000 Y\n0.000000 0.000000 0.000000 Mg\n0.499999 0.500000 0.499999 Hg\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Y",
"Mg",
"Hg"
],
"chemical_system": "Hg-Mg-Y",
"density": 6.451824754346802,
"density_atomic": 0.03859265002837639,
"volume": 103.64667876030491,
"volume_molar": 15.604372220026463,
"formula_full": "Y2 Mg1 Hg1",
"formula_reduced": "Y2MgHg",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.969473175,
"spacegroup": 225
},
{
"id": "jvasp-12773",
"created_at": "2022-09-04T14:37:57.027681Z",
"updated_at": "2022-09-04T14:37:57.027715Z",
"structure_string": "Li6 Br3 N1\n1.0\n5.456958 0.000000 3.150576\n1.818986 5.144869 3.150576\n-0.000000 -0.000000 6.301152\nLi Br N\n6 3 1\ndirect\n0.288250 0.711751 0.711751 Li\n0.288250 0.711751 0.288249 Li\n0.711752 0.288249 0.711751 Li\n0.288249 0.288249 0.711751 Li\n0.711752 0.288249 0.288249 Li\n0.711752 0.711751 0.288249 Li\n0.750001 0.750000 0.750000 Br\n0.250000 0.250000 0.250000 Br\n0.000000 0.000000 0.000000 Br\n0.500001 0.500000 0.500000 N\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Li",
"Br",
"N"
],
"chemical_system": "Br-Li-N",
"density": 2.772444105541591,
"density_atomic": 0.05652689254529589,
"volume": 176.90694729038648,
"volume_molar": 10.65358538004608,
"formula_full": "Li6 Br3 N1",
"formula_reduced": "Li6Br3N",
"formula_anonymous": "AB3C6",
"energy_above_hull": 0.9695085565,
"spacegroup": 225
},
{
"id": "jvasp-1822",
"created_at": "2022-09-04T14:36:22.292506Z",
"updated_at": "2022-09-04T14:36:22.292534Z",
"structure_string": "Li1 Dy1 S2\n1.0\n3.713224 -0.004284 5.373157\n1.672833 3.315069 5.373157\n-0.006970 -0.004284 6.531370\nLi Dy S\n1 1 2\ndirect\n0.499998 0.500001 0.500001 Li\n0.000000 0.000000 0.000000 Dy\n0.249099 0.249101 0.249100 S\n0.750897 0.750902 0.750901 S\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Li",
"Dy",
"S"
],
"chemical_system": "Dy-Li-S",
"density": 4.811090783902179,
"density_atomic": 0.049617573962195884,
"volume": 80.61659772095345,
"volume_molar": 12.137112476696922,
"formula_full": "Li1 Dy1 S2",
"formula_reduced": "LiDyS2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.969606625,
"spacegroup": 166
}
]
}