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=-created_at&page=3852",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-created_at&page=3850",
"results": [
{
"id": "jvasp-86539",
"created_at": "2022-09-04T14:36:07.026113Z",
"updated_at": "2022-09-04T14:36:07.026142Z",
"structure_string": "Na2 Pd1 Se2 O8\n1.0\n4.998614 0.005710 0.315147\n1.885811 5.449008 1.719536\n-0.031608 0.063921 7.216021\nNa Pd Se O\n2 1 2 8\ndirect\n0.798757 0.262149 0.808977 Na\n0.201242 0.737851 0.191024 Na\n0.499999 -0.000000 0.500000 Pd\n0.120796 0.678646 0.719060 Se\n0.879202 0.321354 0.280941 Se\n0.262346 0.785777 0.500980 O\n0.793588 0.683515 0.654577 O\n0.292096 0.385416 0.823486 O\n0.206411 0.316485 0.345424 O\n0.104086 0.858036 0.856820 O\n0.895912 0.141964 0.143181 O\n0.737652 0.214223 0.499021 O\n0.707902 0.614584 0.176515 O\n",
"nsites": 13,
"nelements": 4,
"elements": [
"Na",
"Pd",
"Se",
"O"
],
"chemical_system": "Na-O-Pd-Se",
"density": 3.713252362074292,
"density_atomic": 0.06632276849258795,
"volume": 196.01111798360535,
"volume_molar": 9.0800503309403,
"formula_full": "Na2 Pd1 Se2 O8",
"formula_reduced": "Na2Pd(SeO4)2",
"formula_anonymous": "AB2C2D8",
"energy_above_hull": 2.0299591102564105,
"spacegroup": 2
},
{
"id": "jvasp-15084",
"created_at": "2022-09-04T14:36:07.019798Z",
"updated_at": "2022-09-04T14:36:07.019828Z",
"structure_string": "B4 Os2\n1.0\n2.899284 0.000000 0.000000\n0.000000 4.108149 0.000000\n0.000000 0.000000 4.713592\nB Os\n4 2\ndirect\n0.000000 0.361682 0.806893 B\n0.499999 0.638318 0.693107 B\n0.000000 0.361682 0.193107 B\n0.499999 0.638318 0.306893 B\n0.000000 0.844211 0.000000 Os\n0.499999 0.155789 0.500000 Os\n",
"nsites": 6,
"nelements": 2,
"elements": [
"B",
"Os"
],
"chemical_system": "B-Os",
"density": 12.532067567500707,
"density_atomic": 0.10687160130383595,
"volume": 56.14213623450818,
"volume_molar": 5.6349307828550765,
"formula_full": "B4 Os2",
"formula_reduced": "B2Os",
"formula_anonymous": "AB2",
"energy_above_hull": 4.35619338888889,
"spacegroup": 59
},
{
"id": "jvasp-68553",
"created_at": "2022-09-04T14:36:07.014133Z",
"updated_at": "2022-09-04T14:36:07.014160Z",
"structure_string": "Sc1 Be2 Cl1\n1.0\n3.051346 0.000000 -0.000000\n0.000000 3.051346 0.000000\n0.000000 0.000000 7.064246\nSc Be Cl\n1 2 1\ndirect\n0.500001 0.500001 0.500000 Sc\n0.000000 0.000000 0.746410 Be\n0.000000 0.000000 0.253590 Be\n0.500001 0.500001 0.000000 Cl\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sc",
"Be",
"Cl"
],
"chemical_system": "Be-Cl-Sc",
"density": 2.4850910769041876,
"density_atomic": 0.06081507750167244,
"volume": 65.7731629116151,
"volume_molar": 9.90238113210394,
"formula_full": "Sc1 Be2 Cl1",
"formula_reduced": "ScBe2Cl",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.660100379375,
"spacegroup": 123
},
{
"id": "jvasp-86894",
"created_at": "2022-09-04T14:36:07.009373Z",
"updated_at": "2022-09-04T14:36:07.009400Z",
"structure_string": "Pt2 N4\n1.0\n3.193375 0.000000 0.000000\n0.000000 3.751949 -0.000000\n0.000000 -0.000000 4.861512\nPt N\n2 4\ndirect\n0.000000 0.000000 0.000000 Pt\n0.499999 0.500000 0.500000 Pt\n0.499999 0.348858 0.913967 N\n0.499999 0.651142 0.086033 N\n0.000000 0.151142 0.413967 N\n0.000000 0.848858 0.586033 N\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Pt",
"N"
],
"chemical_system": "N-Pt",
"density": 12.72024255279017,
"density_atomic": 0.10300849473913617,
"volume": 58.24762331684098,
"volume_molar": 5.846256442491241,
"formula_full": "Pt2 N4",
"formula_reduced": "PtN2",
"formula_anonymous": "AB2",
"energy_above_hull": 3.9527393,
"spacegroup": 58
},
{
"id": "jvasp-18419",
"created_at": "2022-09-04T14:36:07.008078Z",
"updated_at": "2022-09-04T14:36:07.008108Z",
"structure_string": "W6 O2\n1.0\n4.884334 0.000000 0.000000\n0.000000 4.884334 0.000000\n0.000000 -0.000000 4.884334\nW O\n6 2\ndirect\n0.749999 0.500000 0.000000 W\n0.500000 0.000000 0.749999 W\n0.000000 0.749999 0.500000 W\n0.250000 0.500000 0.000000 W\n0.500000 0.000000 0.250000 W\n0.000000 0.250000 0.500000 W\n0.500000 0.500000 0.500000 O\n0.000000 0.000000 0.000000 O\n",
"nsites": 8,
"nelements": 2,
"elements": [
"W",
"O"
],
"chemical_system": "O-W",
"density": 16.174979637278557,
"density_atomic": 0.06865527712320485,
"volume": 116.52418190146777,
"volume_molar": 8.771562816931041,
"formula_full": "W6 O2",
"formula_reduced": "W3O",
"formula_anonymous": "AB3",
"energy_above_hull": 6.796965875000001,
"spacegroup": 223
},
{
"id": "jvasp-90554",
"created_at": "2022-09-04T14:36:07.002332Z",
"updated_at": "2022-09-04T14:36:07.002354Z",
"structure_string": "Ce2 Co2 Sb4\n1.0\n4.383968 -0.000000 0.000000\n-0.000000 4.383968 0.000000\n0.000000 0.000000 9.508163\nCe Co Sb\n2 2 4\ndirect\n0.750000 0.750000 0.733176 Ce\n0.250000 0.250000 0.266824 Ce\n0.250000 0.750000 0.500000 Co\n0.750000 0.250000 0.500000 Co\n0.250000 0.750000 0.000000 Sb\n0.750000 0.250000 0.000000 Sb\n0.750000 0.750000 0.356119 Sb\n0.250000 0.250000 0.643880 Sb\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Ce",
"Co",
"Sb"
],
"chemical_system": "Ce-Co-Sb",
"density": 8.043200697899232,
"density_atomic": 0.04377827225902454,
"volume": 182.73905266672247,
"volume_molar": 13.756003718850701,
"formula_full": "Ce2 Co2 Sb4",
"formula_reduced": "CeCoSb2",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.01176715,
"spacegroup": 129
},
{
"id": "jvasp-108154",
"created_at": "2022-09-04T14:36:07.001124Z",
"updated_at": "2022-09-04T14:36:07.001160Z",
"structure_string": "Ca4 Ga1 Si3\n1.0\n4.000483 -0.000000 0.000000\n0.000000 4.483664 0.000000\n-0.000000 -0.000000 10.780367\nCa Ga Si\n4 1 3\ndirect\n0.000000 0.000000 0.363811 Ca\n-0.000000 0.500000 0.859061 Ca\n0.500000 0.500000 0.139456 Ca\n0.500000 0.000000 0.639039 Ca\n0.000000 0.000000 0.071015 Ga\n-0.000000 0.500000 0.569112 Si\n0.500000 0.500000 0.431901 Si\n0.500000 0.000000 0.926608 Si\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Ca",
"Ga",
"Si"
],
"chemical_system": "Ca-Ga-Si",
"density": 2.6989988426130433,
"density_atomic": 0.04137242259980885,
"volume": 193.36551976622616,
"volume_molar": 14.555929727034702,
"formula_full": "Ca4 Ga1 Si3",
"formula_reduced": "Ca4GaSi3",
"formula_anonymous": "AB3C4",
"energy_above_hull": 0.9740949756249996,
"spacegroup": 25
},
{
"id": "jvasp-86081",
"created_at": "2022-09-04T14:36:06.999510Z",
"updated_at": "2022-09-04T14:36:06.999538Z",
"structure_string": "Dy4 Sn10\n1.0\n4.369239 0.000000 0.000000\n-0.000000 4.430197 0.000000\n0.000000 0.000000 19.241675\nDy Sn\n4 10\ndirect\n0.250000 0.750001 0.871575 Dy\n0.250000 0.250000 0.300528 Dy\n0.750000 0.750001 0.699472 Dy\n0.750000 0.250000 0.128425 Dy\n0.250000 0.250000 0.735746 Sn\n0.750000 0.250000 0.424565 Sn\n0.750000 0.250000 0.842872 Sn\n0.750000 0.250000 0.576626 Sn\n0.750000 0.750001 0.264254 Sn\n0.250000 0.750001 0.423373 Sn\n0.250000 0.750001 0.575435 Sn\n0.250000 0.750001 0.157127 Sn\n0.250000 0.250000 0.998445 Sn\n0.750000 0.750001 0.001555 Sn\n",
"nsites": 14,
"nelements": 2,
"elements": [
"Dy",
"Sn"
],
"chemical_system": "Dy-Sn",
"density": 8.190495564837587,
"density_atomic": 0.03758861470998548,
"volume": 372.45320446142637,
"volume_molar": 16.021183026998354,
"formula_full": "Dy4 Sn10",
"formula_reduced": "Dy2Sn5",
"formula_anonymous": "A2B5",
"energy_above_hull": 0.7241587857142857,
"spacegroup": 59
},
{
"id": "jvasp-67775",
"created_at": "2022-09-04T14:36:06.995176Z",
"updated_at": "2022-09-04T14:36:06.995193Z",
"structure_string": "Be1 P1 Cl1\n1.0\n-1.412694 1.412694 6.358966\n1.412694 -1.412694 6.358966\n1.412694 1.412694 -6.358966\nBe P Cl\n1 1 1\ndirect\n0.990971 0.990971 0.000000 Be\n0.624119 0.624119 0.000000 P\n0.384911 0.384911 0.000000 Cl\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Be",
"P",
"Cl"
],
"chemical_system": "Be-Cl-P",
"density": 2.4677547836921785,
"density_atomic": 0.05909878592823363,
"volume": 50.76246411631937,
"volume_molar": 10.18995680776414,
"formula_full": "Be1 P1 Cl1",
"formula_reduced": "BePCl",
"formula_anonymous": "ABC",
"energy_above_hull": 1.5161052224999996,
"spacegroup": 107
},
{
"id": "jvasp-69375",
"created_at": "2022-09-04T14:36:06.994755Z",
"updated_at": "2022-09-04T14:36:06.994776Z",
"structure_string": "Ba1 Sn2 Pb1\n1.0\n4.281755 -0.000000 0.000000\n-0.000000 4.283722 0.000000\n0.000000 0.000000 7.354902\nBa Sn Pb\n1 2 1\ndirect\n0.499999 0.500000 0.500000 Ba\n0.000000 0.000000 0.199523 Sn\n0.000000 0.000000 0.800477 Sn\n0.499999 0.500000 0.000000 Pb\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"Sn",
"Pb"
],
"chemical_system": "Ba-Pb-Sn",
"density": 7.1632902463431005,
"density_atomic": 0.029651045324141832,
"volume": 134.90249521635604,
"volume_molar": 20.310045376703066,
"formula_full": "Ba1 Sn2 Pb1",
"formula_reduced": "BaSn2Pb",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.16905699,
"spacegroup": 123
},
{
"id": "jvasp-15604",
"created_at": "2022-09-04T14:36:06.994338Z",
"updated_at": "2022-09-04T14:36:06.994360Z",
"structure_string": "Lu1 B2 Ru3\n1.0\n2.734261 -4.735880 -0.000000\n2.734261 4.735880 -0.000000\n-0.000000 0.000000 3.023482\nLu B Ru\n1 2 3\ndirect\n0.000000 0.000000 0.000000 Lu\n0.333333 0.666667 0.000000 B\n0.666667 0.333333 0.000000 B\n0.500000 0.500000 0.500000 Ru\n0.500000 -0.000000 0.500000 Ru\n-0.000000 0.500000 0.500000 Ru\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Lu",
"B",
"Ru"
],
"chemical_system": "B-Lu-Ru",
"density": 10.599037769860196,
"density_atomic": 0.07662548031434135,
"volume": 78.3029349426085,
"volume_molar": 7.859188269091849,
"formula_full": "Lu1 B2 Ru3",
"formula_reduced": "LuB2Ru3",
"formula_anonymous": "AB2C3",
"energy_above_hull": 4.322028736111111,
"spacegroup": 191
},
{
"id": "jvasp-98662",
"created_at": "2022-09-04T14:36:06.992514Z",
"updated_at": "2022-09-04T14:36:06.992540Z",
"structure_string": "Y4 N12 O36\n1.0\n10.915349 0.000000 -0.636151\n0.000000 6.129726 0.000000\n-0.100661 0.000000 9.500613\nY N O\n4 12 36\ndirect\n0.736946 0.331765 0.714463 Y\n0.263054 0.831765 0.785536 Y\n0.263054 0.668236 0.285537 Y\n0.736946 0.168236 0.214463 Y\n0.889015 0.216368 0.978400 N\n0.110985 0.716369 0.521600 N\n0.110985 0.783633 0.021600 N\n0.889015 0.283632 0.478400 N\n0.790850 0.719179 0.203525 N\n0.209150 0.219179 0.296475 N\n0.209151 0.280821 0.796475 N\n0.493057 0.877926 0.332485 N\n0.506943 0.377926 0.167515 N\n0.506943 0.122075 0.667515 N\n0.493058 0.622075 0.832485 N\n0.790850 0.780822 0.703525 N\n0.768342 0.268283 0.460020 O\n0.181925 0.020447 0.301995 O\n0.167166 0.163191 0.694357 O\n0.832834 0.663192 0.805642 O\n0.832834 0.836809 0.305643 O\n0.167166 0.336809 0.194357 O\n0.231658 0.768283 0.039980 O\n0.048768 0.726600 0.118881 O\n0.768342 0.231718 0.960020 O\n0.930137 0.355326 0.596358 O\n0.069864 0.855326 0.903642 O\n0.069864 0.644675 0.403642 O\n0.930136 0.144674 0.096358 O\n0.951232 0.226599 0.381119 O\n0.818075 0.520448 0.198005 O\n0.231658 0.731718 0.539980 O\n0.818075 0.979553 0.698005 O\n0.401736 0.041054 0.649917 O\n0.277887 0.309491 0.394055 O\n0.421163 0.576553 0.724314 O\n0.578837 0.076552 0.775686 O\n0.578837 0.423448 0.275686 O\n0.421163 0.923448 0.224314 O\n0.453841 0.754475 0.922226 O\n0.546160 0.254475 0.577773 O\n0.546160 0.245526 0.077774 O\n0.453841 0.745526 0.422226 O\n0.598264 0.541054 0.850083 O\n0.048768 0.773401 0.618881 O\n0.401736 0.458946 0.149917 O\n0.598264 0.958947 0.350083 O\n0.277887 0.190509 0.894055 O\n0.722113 0.690510 0.605945 O\n0.722113 0.809491 0.105945 O\n0.181926 0.479553 0.801994 O\n0.951232 0.273401 0.881119 O\n",
"nsites": 52,
"nelements": 3,
"elements": [
"Y",
"N",
"O"
],
"chemical_system": "N-O-Y",
"density": 2.8744465261041188,
"density_atomic": 0.08185425960793517,
"volume": 635.2754303694047,
"volume_molar": 7.35715012125795,
"formula_full": "Y4 N12 O36",
"formula_reduced": "Y(NO3)3",
"formula_anonymous": "AB3C9",
"energy_above_hull": 3.708696669230769,
"spacegroup": 14
}
]
}