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=96",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=updated_at&page=94",
"results": [
{
"id": "jvasp-86982",
"created_at": "2022-09-04T14:35:43.813154Z",
"updated_at": "2022-09-04T14:35:43.813179Z",
"structure_string": "Rb1 Cr5 S8\n1.0\n3.416918 -0.000000 -0.661352\n-0.408634 8.444596 -2.111237\n-0.040848 0.013315 8.946506\nRb Cr S\n1 5 8\ndirect\n0.500001 0.500000 0.000000 Rb\n0.295814 0.665256 0.591626 Cr\n0.704188 0.334745 0.408374 Cr\n0.345096 0.024567 0.690191 Cr\n0.654905 0.975434 0.309809 Cr\n0.000000 0.000000 0.000000 Cr\n0.237814 0.154263 0.475627 S\n0.762187 0.845738 0.524374 S\n0.170094 0.488411 0.340186 S\n0.829907 0.511590 0.659814 S\n0.086264 0.824221 0.172525 S\n0.913738 0.175780 0.827475 S\n0.426180 0.845100 0.852359 S\n0.573821 0.154901 0.147641 S\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Rb",
"Cr",
"S"
],
"chemical_system": "Cr-Rb-S",
"density": 3.8741107102641505,
"density_atomic": 0.05425969446420271,
"volume": 258.0184082908237,
"volume_molar": 11.098736952846368,
"formula_full": "Rb1 Cr5 S8",
"formula_reduced": "RbCr5S8",
"formula_anonymous": "AB5C8",
"energy_above_hull": 3.305161928571429,
"spacegroup": 12
},
{
"id": "jvasp-67799",
"created_at": "2022-09-04T14:35:43.815071Z",
"updated_at": "2022-09-04T14:35:43.815100Z",
"structure_string": "Hf1 Be2 In1\n1.0\n4.091582 0.000000 0.000000\n0.000000 4.091582 -0.000000\n0.000000 0.000000 3.660867\nHf Be In\n1 2 1\ndirect\n0.500000 0.500000 0.500000 Hf\n0.500000 0.000000 0.000000 Be\n0.000000 0.500000 0.000000 Be\n0.000000 0.000000 0.500000 In\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Hf",
"Be",
"In"
],
"chemical_system": "Be-Hf-In",
"density": 8.435423610947444,
"density_atomic": 0.06526698056088784,
"volume": 61.28673282607862,
"volume_molar": 9.22693329497895,
"formula_full": "Hf1 Be2 In1",
"formula_reduced": "HfBe2In",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.1797412925,
"spacegroup": 123
},
{
"id": "jvasp-91782",
"created_at": "2022-09-04T14:35:43.815696Z",
"updated_at": "2022-09-04T14:35:43.815730Z",
"structure_string": "Tb2 Fe2 Ge4\n1.0\n0.000000 -0.000000 -4.216228\n-4.157823 0.000000 0.000000\n2.078911 8.280830 -0.000000\nTb Fe Ge\n2 2 4\ndirect\n0.750000 0.108831 0.217661 Tb\n0.250000 0.891168 0.782339 Tb\n0.750000 0.318193 0.636385 Fe\n0.250000 0.681807 0.363616 Fe\n0.750000 0.454628 0.909257 Ge\n0.250000 0.545371 0.090743 Ge\n0.750000 0.749202 0.498406 Ge\n0.250000 0.250797 0.501594 Ge\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Tb",
"Fe",
"Ge"
],
"chemical_system": "Fe-Ge-Tb",
"density": 8.237176583162523,
"density_atomic": 0.05510944440512071,
"volume": 145.16568051730619,
"volume_molar": 10.927602019955092,
"formula_full": "Tb2 Fe2 Ge4",
"formula_reduced": "TbFeGe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.49032645,
"spacegroup": 63
},
{
"id": "jvasp-94117",
"created_at": "2022-09-04T14:35:43.817682Z",
"updated_at": "2022-09-04T14:35:43.817710Z",
"structure_string": "Mg6 Ti1 Co1\n1.0\n6.262008 -0.147022 0.000000\n-3.258329 5.349548 0.000000\n0.000000 0.000000 4.682255\nMg Ti Co\n6 1 1\ndirect\n0.176400 0.844664 0.250000 Mg\n0.655337 0.323601 0.250000 Mg\n0.671837 0.828164 0.250000 Mg\n0.318391 0.662128 0.750001 Mg\n0.837873 0.181610 0.750001 Mg\n0.832821 0.667179 0.750001 Mg\n0.305936 0.194064 0.750001 Ti\n0.201406 0.298594 0.250000 Co\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Mg",
"Ti",
"Co"
],
"chemical_system": "Co-Mg-Ti",
"density": 2.7133385296610952,
"density_atomic": 0.051743954235707566,
"volume": 154.60743420492872,
"volume_molar": 11.638346641556494,
"formula_full": "Mg6 Ti1 Co1",
"formula_reduced": "Mg6TiCo",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.3083166916666667,
"spacegroup": 38
},
{
"id": "jvasp-66405",
"created_at": "2022-09-04T14:35:43.828768Z",
"updated_at": "2022-09-04T14:35:43.828798Z",
"structure_string": "Ba1 Hg1 Sb1\n1.0\n-0.000000 3.957095 3.957095\n3.957095 0.000000 3.957095\n3.957095 3.957095 -0.000000\nBa Hg Sb\n1 1 1\ndirect\n0.749999 0.749999 0.749999 Ba\n0.000000 0.000000 0.000000 Hg\n0.499999 0.499999 0.499999 Sb\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ba",
"Hg",
"Sb"
],
"chemical_system": "Ba-Hg-Sb",
"density": 6.159457258838491,
"density_atomic": 0.024208162664706566,
"volume": 123.92514217420324,
"volume_molar": 24.876488329202143,
"formula_full": "Ba1 Hg1 Sb1",
"formula_reduced": "BaHgSb",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0,
"spacegroup": 216
},
{
"id": "jvasp-48817",
"created_at": "2022-09-04T14:35:43.834982Z",
"updated_at": "2022-09-04T14:35:43.835011Z",
"structure_string": "Fe4 O2 F6\n1.0\n-0.132598 4.657010 2.981537\n-0.132598 4.657010 -2.981537\n-4.657010 0.132598 -2.981537\nFe O F\n4 2 6\ndirect\n0.750000 0.750000 0.500001 Fe\n0.250000 0.250000 0.500000 Fe\n-0.000000 0.972949 0.027052 Fe\n0.500000 0.527052 0.972949 Fe\n0.500000 0.808902 0.691099 O\n-0.000000 0.691098 0.308902 O\n0.563188 0.250000 0.813188 F\n0.063188 0.750001 0.813188 F\n-0.000000 0.278319 0.721682 F\n0.500000 0.221682 0.278318 F\n0.936812 0.250000 0.186813 F\n0.436812 0.750000 0.186813 F\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Fe",
"O",
"F"
],
"chemical_system": "F-Fe-O",
"density": 4.746543702418523,
"density_atomic": 0.09286433029122544,
"volume": 129.220767138121,
"volume_molar": 6.484880406841225,
"formula_full": "Fe4 O2 F6",
"formula_reduced": "Fe2OF3",
"formula_anonymous": "AB2C3",
"energy_above_hull": 1.3411408912500002,
"spacegroup": 74
},
{
"id": "jvasp-52219",
"created_at": "2022-09-04T14:35:43.837210Z",
"updated_at": "2022-09-04T14:35:43.837232Z",
"structure_string": "U3 O5\n1.0\n-3.828672 -0.000184 0.001477\n1.913858 3.315793 -0.003052\n-0.003313 -0.006481 -9.411072\nU O\n3 5\ndirect\n0.004179 0.998276 0.000119 U\n0.670809 0.331602 0.658706 U\n0.337476 0.664922 0.329372 U\n0.670819 0.331594 0.414560 O\n0.004117 -0.001749 0.761634 O\n0.337442 0.664921 0.580867 O\n0.004138 0.998262 0.243163 O\n0.337566 0.664961 0.057356 O\n",
"nsites": 8,
"nelements": 2,
"elements": [
"U",
"O"
],
"chemical_system": "O-U",
"density": 11.037037195084226,
"density_atomic": 0.06696179667111148,
"volume": 119.47110737324861,
"volume_molar": 8.993397816934714,
"formula_full": "U3 O5",
"formula_reduced": "U3O5",
"formula_anonymous": "A3B5",
"energy_above_hull": 3.9581894375,
"spacegroup": 156
},
{
"id": "jvasp-75655",
"created_at": "2022-09-04T14:35:43.844903Z",
"updated_at": "2022-09-04T14:35:43.844930Z",
"structure_string": "Na1 Mo2 As1\n1.0\n-0.000000 3.169430 3.169430\n3.169430 -0.000000 3.169430\n3.169430 3.169430 0.000000\nNa Mo As\n1 2 1\ndirect\n0.750000 0.750000 0.750000 Na\n0.000000 0.000000 0.000000 Mo\n0.250000 0.250000 0.250000 Mo\n0.500000 0.500000 0.500000 As\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Na",
"Mo",
"As"
],
"chemical_system": "As-Mo-Na",
"density": 7.557202430427727,
"density_atomic": 0.06281834675290762,
"volume": 63.67566494122763,
"volume_molar": 9.586595431566748,
"formula_full": "Na1 Mo2 As1",
"formula_reduced": "NaMo2As",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.4899831375000003,
"spacegroup": 216
},
{
"id": "jvasp-22625",
"created_at": "2022-09-04T14:35:43.844940Z",
"updated_at": "2022-09-04T14:35:43.844961Z",
"structure_string": "S4 O12\n1.0\n4.081527 0.000000 0.000000\n0.000000 5.742739 -2.042288\n0.000000 -0.123499 8.955103\nS O\n4 12\ndirect\n0.523908 0.387164 0.205488 S\n0.476093 0.612836 0.794511 S\n0.976093 0.887164 0.705488 S\n0.023907 0.112836 0.294511 S\n0.307082 0.652545 0.938886 O\n0.144067 0.093068 0.795178 O\n0.644068 0.406931 0.704821 O\n0.192918 0.152545 0.438886 O\n0.727226 0.837958 0.835027 O\n0.807083 0.847455 0.561113 O\n0.355933 0.593069 0.295179 O\n0.272774 0.162042 0.164973 O\n0.855933 0.906932 0.204821 O\n0.772775 0.337958 0.335027 O\n0.692918 0.347455 0.061113 O\n0.227226 0.662042 0.664973 O\n",
"nsites": 16,
"nelements": 2,
"elements": [
"S",
"O"
],
"chemical_system": "O-S",
"density": 2.546038187798878,
"density_atomic": 0.07660248579901267,
"volume": 208.87050639557998,
"volume_molar": 7.861547438291645,
"formula_full": "S4 O12",
"formula_reduced": "SO3",
"formula_anonymous": "AB3",
"energy_above_hull": 2.015880125,
"spacegroup": 14
},
{
"id": "jvasp-85324",
"created_at": "2022-09-04T14:35:43.846580Z",
"updated_at": "2022-09-04T14:35:43.846608Z",
"structure_string": "Sm6 Ge10\n1.0\n5.577359 -0.000095 1.860263\n2.788559 7.011356 0.930133\n-0.001480 0.000002 9.297806\nSm Ge\n6 10\ndirect\n0.249388 0.501197 0.500007 Sm\n0.666079 0.986354 0.663070 Sm\n0.999405 0.001180 -0.000004 Sm\n0.579145 0.486358 0.836920 Sm\n0.347561 0.986351 0.336933 Sm\n0.934488 0.486358 0.163073 Sm\n0.388547 0.687995 0.135893 Ge\n0.923497 0.687961 0.864070 Ge\n0.916273 0.826356 0.325587 Ge\n0.037615 0.187944 0.635947 Ge\n0.491844 0.326366 0.174409 Ge\n0.448593 0.102782 0.000017 Ge\n0.257406 0.826334 0.674425 Ge\n0.774414 0.187975 0.364081 Ge\n0.181824 0.326337 0.825586 Ge\n0.698624 0.602748 0.499982 Ge\n",
"nsites": 16,
"nelements": 2,
"elements": [
"Sm",
"Ge"
],
"chemical_system": "Ge-Sm",
"density": 7.43730793066853,
"density_atomic": 0.04400306061740745,
"volume": 363.61107103696463,
"volume_molar": 13.685731572993502,
"formula_full": "Sm6 Ge10",
"formula_reduced": "Sm3Ge5",
"formula_anonymous": "A3B5",
"energy_above_hull": 1.1568382968749995,
"spacegroup": 43
},
{
"id": "jvasp-50807",
"created_at": "2022-09-04T14:35:43.852060Z",
"updated_at": "2022-09-04T14:35:43.852094Z",
"structure_string": "Ho6 Re1 O12\n1.0\n4.880189 2.817580 3.096967\n-4.880190 2.817579 3.096967\n0.000000 -5.635158 3.096967\nHo Re O\n6 1 12\ndirect\n0.389040 0.856301 0.685233 Ho\n0.314768 0.610961 0.143700 Ho\n0.143700 0.314768 0.610961 Ho\n0.856301 0.685233 0.389040 Ho\n0.685233 0.389040 0.856301 Ho\n0.610961 0.143700 0.314768 Ho\n0.000000 0.000000 0.000000 Re\n0.822761 0.410496 0.567860 O\n0.432142 0.177240 0.589505 O\n0.926056 0.702058 0.035576 O\n0.589505 0.432141 0.177240 O\n0.410496 0.567859 0.822761 O\n0.177240 0.589505 0.432141 O\n0.567860 0.822761 0.410496 O\n0.702058 0.035576 0.926056 O\n0.297943 0.964426 0.073945 O\n0.035576 0.926056 0.702058 O\n0.073945 0.297943 0.964426 O\n0.964426 0.073945 0.297943 O\n",
"nsites": 19,
"nelements": 3,
"elements": [
"Ho",
"Re",
"O"
],
"chemical_system": "Ho-O-Re",
"density": 8.889252672131835,
"density_atomic": 0.07436232488648772,
"volume": 255.50572859311535,
"volume_molar": 8.098376118811037,
"formula_full": "Ho6 Re1 O12",
"formula_reduced": "Ho6ReO12",
"formula_anonymous": "AB6C12",
"energy_above_hull": 2.75650807368421,
"spacegroup": 148
},
{
"id": "jvasp-70872",
"created_at": "2022-09-04T14:35:43.853080Z",
"updated_at": "2022-09-04T14:35:43.853097Z",
"structure_string": "Y1 Be1 Mo4\n1.0\n-0.000000 3.772319 3.772319\n3.772319 -0.000000 3.772319\n3.772319 3.772319 -0.000000\nY Be Mo\n1 1 4\ndirect\n0.250000 0.250000 0.250000 Y\n0.000000 0.000000 0.000000 Be\n0.122514 0.625829 0.625829 Mo\n0.625829 0.625829 0.625829 Mo\n0.625829 0.122514 0.625829 Mo\n0.625829 0.625829 0.122514 Mo\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Y",
"Be",
"Mo"
],
"chemical_system": "Be-Mo-Y",
"density": 7.44990455061094,
"density_atomic": 0.055885098618549164,
"volume": 107.36314596049587,
"volume_molar": 10.775932956842192,
"formula_full": "Y1 Be1 Mo4",
"formula_reduced": "YBeMo4",
"formula_anonymous": "ABC4",
"energy_above_hull": 5.381367525000001,
"spacegroup": 216
}
]
}