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=-nsites&page=849",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-nsites&page=847",
"results": [
{
"id": "jvasp-20154",
"created_at": "2022-09-04T14:37:41.862943Z",
"updated_at": "2022-09-04T14:37:41.862956Z",
"structure_string": "Nd10 Ge6\n1.0\n4.413784 -7.644899 0.000000\n4.413784 7.644899 -0.000000\n0.000000 0.000000 6.694929\nNd Ge\n10 6\ndirect\n0.246273 -0.000000 0.250000 Nd\n0.753727 -0.000000 0.750000 Nd\n0.246273 0.246273 0.750000 Nd\n-0.000000 0.246273 0.250000 Nd\n0.753727 0.753727 0.250000 Nd\n-0.000000 0.753727 0.750000 Nd\n0.333333 0.666667 0.500000 Nd\n0.666667 0.333333 0.000000 Nd\n0.666667 0.333333 0.500000 Nd\n0.333333 0.666667 0.000000 Nd\n-0.000000 0.608261 0.250000 Ge\n0.608261 0.608261 0.750000 Ge\n0.391738 -0.000000 0.750000 Ge\n0.608261 -0.000000 0.250000 Ge\n0.391738 0.391738 0.250000 Ge\n-0.000000 0.391738 0.750000 Ge\n",
"nsites": 16,
"nelements": 2,
"elements": [
"Nd",
"Ge"
],
"chemical_system": "Ge-Nd",
"density": 6.903129294353217,
"density_atomic": 0.035412874732521214,
"volume": 451.81307987138615,
"volume_molar": 17.005512276216315,
"formula_full": "Nd10 Ge6",
"formula_reduced": "Nd5Ge3",
"formula_anonymous": "A3B5",
"energy_above_hull": 1.45188941875,
"spacegroup": 193
},
{
"id": "jvasp-22862",
"created_at": "2022-09-04T14:37:34.720854Z",
"updated_at": "2022-09-04T14:37:34.720879Z",
"structure_string": "Sc10 Ge6\n1.0\n3.966968 -6.870991 -0.000000\n3.966968 6.870991 0.000000\n-0.000000 -0.000000 5.887145\nSc Ge\n10 6\ndirect\n0.333333 0.666667 0.000000 Sc\n0.666667 0.333333 0.500000 Sc\n0.666667 0.333333 0.000000 Sc\n0.333333 0.666667 0.500000 Sc\n0.240507 0.000000 0.250000 Sc\n0.240507 0.240507 0.749999 Sc\n0.000000 0.759493 0.749999 Sc\n0.000000 0.240507 0.250000 Sc\n0.759493 0.759493 0.250000 Sc\n0.759493 0.000000 0.749999 Sc\n0.607005 0.000000 0.250000 Ge\n0.607006 0.607006 0.749999 Ge\n0.000000 0.392995 0.749999 Ge\n0.000000 0.607005 0.250000 Ge\n0.392995 0.392995 0.250000 Ge\n0.392995 0.000000 0.749999 Ge\n",
"nsites": 16,
"nelements": 2,
"elements": [
"Sc",
"Ge"
],
"chemical_system": "Ge-Sc",
"density": 4.581159137860004,
"density_atomic": 0.04985482286304896,
"volume": 320.93183931175423,
"volume_molar": 12.079354441881785,
"formula_full": "Sc10 Ge6",
"formula_reduced": "Sc5Ge3",
"formula_anonymous": "A3B5",
"energy_above_hull": 2.1370680125,
"spacegroup": 193
},
{
"id": "jvasp-20756",
"created_at": "2022-09-04T14:37:41.942212Z",
"updated_at": "2022-09-04T14:37:41.942233Z",
"structure_string": "Ni4 P12\n1.0\n6.442023 0.000000 -2.277599\n-3.221011 5.578956 -2.277599\n-0.000000 -0.000000 6.832797\nNi P\n4 12\ndirect\n0.500000 -0.000000 -0.000000 Ni\n0.000000 0.000000 0.500000 Ni\n0.000000 0.500000 0.000000 Ni\n0.500000 0.500000 0.500000 Ni\n0.502287 0.857692 0.644596 P\n0.213097 0.857692 0.355405 P\n0.786904 0.142309 0.644596 P\n0.142309 0.355405 0.497713 P\n0.497713 0.142309 0.355405 P\n0.142309 0.644596 0.786904 P\n0.355405 0.213096 0.857692 P\n0.857692 0.644596 0.502287 P\n0.644596 0.786904 0.142309 P\n0.857691 0.355405 0.213096 P\n0.644595 0.502287 0.857692 P\n0.355405 0.497713 0.142309 P\n",
"nsites": 16,
"nelements": 2,
"elements": [
"Ni",
"P"
],
"chemical_system": "Ni-P",
"density": 4.1008759680221925,
"density_atomic": 0.06515477617324043,
"volume": 245.56910390509978,
"volume_molar": 9.242823187647353,
"formula_full": "Ni4 P12",
"formula_reduced": "NiP3",
"formula_anonymous": "AB3",
"energy_above_hull": 2.4141422250000004,
"spacegroup": 204
},
{
"id": "jvasp-21683",
"created_at": "2022-09-04T14:37:34.249491Z",
"updated_at": "2022-09-04T14:37:34.249518Z",
"structure_string": "Tb4 F12\n1.0\n4.379917 0.000000 0.000000\n-0.000000 6.473404 0.000000\n0.000000 0.000000 6.921688\nTb F\n4 12\ndirect\n0.935309 0.630713 0.750000 Tb\n0.435309 0.869286 0.250000 Tb\n0.564691 0.130713 0.750000 Tb\n0.064691 0.369287 0.250000 Tb\n0.384088 0.165721 0.436942 F\n0.884089 0.334278 0.563059 F\n0.115912 0.665721 0.063059 F\n0.615912 0.834278 0.936942 F\n0.583212 0.520815 0.250000 F\n0.083211 0.979184 0.750000 F\n0.916789 0.020815 0.250000 F\n0.416789 0.479185 0.750000 F\n0.384088 0.165721 0.063059 F\n0.884089 0.334278 0.936942 F\n0.115912 0.665721 0.436942 F\n0.615912 0.834278 0.563059 F\n",
"nsites": 16,
"nelements": 2,
"elements": [
"Tb",
"F"
],
"chemical_system": "F-Tb",
"density": 7.307897951116305,
"density_atomic": 0.08152848476879665,
"volume": 196.25042763119853,
"volume_molar": 7.386548121282944,
"formula_full": "Tb4 F12",
"formula_reduced": "TbF3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 62
},
{
"id": "jvasp-12048",
"created_at": "2022-09-04T14:37:56.728059Z",
"updated_at": "2022-09-04T14:37:56.728075Z",
"structure_string": "Bi4 Br12\n1.0\n7.164619 0.000000 -0.197611\n0.000000 12.416967 0.000000\n-2.188132 0.000000 6.479051\nBi Br\n4 12\ndirect\n0.500341 0.333647 0.000276 Bi\n-0.000341 0.833647 -0.000276 Bi\n0.000341 0.166353 0.000276 Bi\n0.499659 0.666354 -0.000276 Bi\n0.247590 0.168439 0.742949 Br\n0.254405 0.499822 0.736420 Br\n0.253406 0.331328 0.257909 Br\n0.246594 0.831328 0.742091 Br\n0.245595 -0.000178 0.263580 Br\n0.747590 0.331561 0.742949 Br\n0.252410 0.668439 0.257051 Br\n0.754405 0.000178 0.736420 Br\n0.753406 0.168672 0.257909 Br\n0.746594 0.668672 0.742092 Br\n0.745595 0.500178 0.263580 Br\n0.752410 0.831561 0.257051 Br\n",
"nsites": 16,
"nelements": 2,
"elements": [
"Bi",
"Br"
],
"chemical_system": "Bi-Br",
"density": 5.219178657062037,
"density_atomic": 0.02801975565913495,
"volume": 571.0256789760302,
"volume_molar": 21.492481352301418,
"formula_full": "Bi4 Br12",
"formula_reduced": "BiBr3",
"formula_anonymous": "AB3",
"energy_above_hull": 2.749999999998587e-05,
"spacegroup": 12
},
{
"id": "jvasp-4219",
"created_at": "2022-09-04T14:37:42.398033Z",
"updated_at": "2022-09-04T14:37:42.398050Z",
"structure_string": "Al4 I12\n1.0\n0.000000 9.610161 -0.083708\n6.036528 0.000000 0.000000\n0.000000 -3.759411 -11.304149\nAl I\n4 12\ndirect\n0.196664 0.001485 0.048784 Al\n0.803336 0.501485 0.451216 Al\n0.803336 0.998515 0.951216 Al\n0.196664 0.498515 0.548784 Al\n0.331992 0.748953 0.211820 I\n0.668008 0.248952 0.288180 I\n0.668008 0.251048 0.788180 I\n0.331992 0.751048 0.711820 I\n0.330212 0.255362 0.951962 I\n0.669788 0.755362 0.548038 I\n0.669788 0.744638 0.048038 I\n0.330212 0.244638 0.451962 I\n0.000689 0.768649 0.881097 I\n0.999311 0.268648 0.618903 I\n0.999311 0.231352 0.118903 I\n0.000689 0.731352 0.381097 I\n",
"nsites": 16,
"nelements": 2,
"elements": [
"Al",
"I"
],
"chemical_system": "Al-I",
"density": 4.11748872185753,
"density_atomic": 0.02432808819874354,
"volume": 657.676010925772,
"volume_molar": 24.75385945168935,
"formula_full": "Al4 I12",
"formula_reduced": "AlI3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.01174290625,
"spacegroup": 14
},
{
"id": "jvasp-21842",
"created_at": "2022-09-04T14:37:35.371323Z",
"updated_at": "2022-09-04T14:37:35.371332Z",
"structure_string": "Er10 Sb6\n1.0\n4.439434 -7.689324 -0.000000\n4.439434 7.689324 -0.000000\n-0.000000 0.000000 6.203875\nEr Sb\n10 6\ndirect\n0.245307 -0.000000 0.250000 Er\n0.754693 -0.000000 0.750001 Er\n0.245307 0.245307 0.750001 Er\n-0.000000 0.245307 0.250000 Er\n0.754693 0.754693 0.250000 Er\n-0.000000 0.754693 0.750001 Er\n0.333333 0.666667 0.500000 Er\n0.666667 0.333333 0.000000 Er\n0.666667 0.333333 0.500000 Er\n0.333333 0.666667 0.000000 Er\n-0.000000 0.611789 0.250000 Sb\n0.611789 0.611789 0.750001 Sb\n0.388211 -0.000000 0.750001 Sb\n0.611789 -0.000000 0.250000 Sb\n0.388211 0.388211 0.250000 Sb\n-0.000000 0.388211 0.750001 Sb\n",
"nsites": 16,
"nelements": 2,
"elements": [
"Er",
"Sb"
],
"chemical_system": "Er-Sb",
"density": 9.421524413456533,
"density_atomic": 0.0377755836872232,
"volume": 423.5540113020587,
"volume_molar": 15.94188672202268,
"formula_full": "Er10 Sb6",
"formula_reduced": "Er5Sb3",
"formula_anonymous": "A3B5",
"energy_above_hull": 1.5868885375,
"spacegroup": 193
},
{
"id": "jvasp-85486",
"created_at": "2022-09-04T14:35:40.898238Z",
"updated_at": "2022-09-04T14:35:40.898266Z",
"structure_string": "Te2 Pb4 O10\n1.0\n5.335403 -0.000803 2.282050\n1.762926 6.141868 3.255544\n0.012907 -0.048641 7.352156\nTe Pb O\n2 4 10\ndirect\n0.048968 0.216168 0.685748 Te\n0.048995 0.716167 0.185750 Te\n0.381840 0.536009 0.684451 Pb\n0.716064 0.896339 0.687068 Pb\n0.397495 0.035967 0.184814 Pb\n0.700492 0.396378 0.186706 Pb\n0.293103 0.696273 0.315879 O\n0.988795 0.422751 0.814623 O\n0.804900 0.736065 0.055609 O\n0.694557 0.196234 0.815963 O\n0.773440 0.922167 0.315207 O\n0.403375 0.236101 0.555524 O\n0.324546 0.510160 0.056303 O\n0.109140 0.009576 0.556887 O\n0.181631 0.966477 0.935946 O\n0.916327 0.465868 0.435556 O\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Te",
"Pb",
"O"
],
"chemical_system": "O-Pb-Te",
"density": 8.55702859576828,
"density_atomic": 0.06627894437930723,
"volume": 241.403965465016,
"volume_molar": 9.086054125328157,
"formula_full": "Te2 Pb4 O10",
"formula_reduced": "TePb2O5",
"formula_anonymous": "AB2C5",
"energy_above_hull": 1.8021446133333328,
"spacegroup": 15
},
{
"id": "jvasp-86295",
"created_at": "2022-09-04T14:35:43.487603Z",
"updated_at": "2022-09-04T14:35:43.487631Z",
"structure_string": "Zr4 I12\n1.0\n6.554240 -0.000000 0.000000\n0.000000 7.329765 0.000000\n0.000000 0.000000 12.694960\nZr I\n4 12\ndirect\n0.499875 0.249792 0.750000 Zr\n0.000125 0.249792 0.750000 Zr\n0.500125 0.750207 0.250000 Zr\n-0.000125 0.750207 0.250000 Zr\n0.250000 0.414871 0.915038 I\n0.250000 0.919696 0.750000 I\n0.250000 0.915155 0.084967 I\n0.250000 0.915155 0.415033 I\n0.750000 0.084844 0.584967 I\n0.750000 0.585128 0.415038 I\n0.750000 0.579823 0.750000 I\n0.750000 0.084844 0.915033 I\n0.750000 0.585128 0.084962 I\n0.750000 0.080303 0.250000 I\n0.250000 0.420176 0.250000 I\n0.250000 0.414871 0.584962 I\n",
"nsites": 16,
"nelements": 2,
"elements": [
"Zr",
"I"
],
"chemical_system": "I-Zr",
"density": 5.139841962612958,
"density_atomic": 0.02623470921172071,
"volume": 609.8790678743939,
"volume_molar": 22.954859958232465,
"formula_full": "Zr4 I12",
"formula_reduced": "ZrI3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.5904258312500001,
"spacegroup": 193
},
{
"id": "jvasp-99254",
"created_at": "2022-09-04T14:35:46.887205Z",
"updated_at": "2022-09-04T14:35:46.887230Z",
"structure_string": "Rb4 V2 Ag2 S8\n1.0\n5.627716 -0.000000 1.412755\n2.813858 6.658142 0.706378\n0.014091 -0.000000 11.859265\nRb V Ag S\n4 2 2 8\ndirect\n0.444134 0.750000 0.111734 Rb\n0.194133 0.250000 0.611734 Rb\n0.805868 0.750000 0.388265 Rb\n0.555868 0.250000 0.888265 Rb\n0.625001 0.750000 0.750000 V\n0.375000 0.250000 0.250000 V\n0.125000 0.750000 0.750000 Ag\n0.875001 0.250000 0.250000 Ag\n0.871765 0.553365 0.862299 S\n0.265937 0.946634 0.862299 S\n0.574872 0.553365 0.637700 S\n0.787429 0.946634 0.637700 S\n0.425130 0.446635 0.362299 S\n0.212572 0.053365 0.362299 S\n0.734064 0.053365 0.137700 S\n0.128237 0.446635 0.137701 S\n",
"nsites": 16,
"nelements": 4,
"elements": [
"Rb",
"V",
"Ag",
"S"
],
"chemical_system": "Ag-Rb-S-V",
"density": 3.4240189225770594,
"density_atomic": 0.036016917575038374,
"volume": 444.23568359688966,
"volume_molar": 16.72031135772058,
"formula_full": "Rb4 V2 Ag2 S8",
"formula_reduced": "Rb2VAgS4",
"formula_anonymous": "ABC2D4",
"energy_above_hull": 1.2931026825,
"spacegroup": 70
},
{
"id": "jvasp-50342",
"created_at": "2022-09-04T14:35:41.570231Z",
"updated_at": "2022-09-04T14:35:41.570264Z",
"structure_string": "Na2 Cu6 O8\n1.0\n5.470205 0.000000 -0.000000\n-0.000000 5.470205 -0.000000\n-0.000000 0.000000 5.470205\nNa Cu O\n2 6 8\ndirect\n0.000000 0.000000 0.000000 Na\n0.500000 0.500000 0.500000 Na\n0.000000 0.500000 0.250000 Cu\n0.000000 0.500000 0.749999 Cu\n0.250000 0.000000 0.500000 Cu\n0.500000 0.250000 0.000000 Cu\n0.500000 0.749999 0.000000 Cu\n0.749999 0.000000 0.500000 Cu\n0.250000 0.250000 0.250000 O\n0.250000 0.749999 0.250000 O\n0.250000 0.250000 0.749999 O\n0.250000 0.749999 0.749999 O\n0.749999 0.250000 0.250000 O\n0.749999 0.250000 0.749999 O\n0.749999 0.749999 0.250000 O\n0.749999 0.749999 0.749999 O\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Na",
"Cu",
"O"
],
"chemical_system": "Cu-Na-O",
"density": 5.632840266885757,
"density_atomic": 0.09774829170829191,
"volume": 163.68572504313886,
"volume_molar": 6.160865478827747,
"formula_full": "Na2 Cu6 O8",
"formula_reduced": "NaCu3O4",
"formula_anonymous": "AB3C4",
"energy_above_hull": 0.998758925,
"spacegroup": 223
},
{
"id": "jvasp-85533",
"created_at": "2022-09-04T14:35:41.379957Z",
"updated_at": "2022-09-04T14:35:41.379980Z",
"structure_string": "Ba6 Pb10\n1.0\n7.273578 0.013468 0.000000\n-1.483169 7.120768 -0.000000\n-0.000000 0.000000 11.458990\nBa Pb\n6 10\ndirect\n0.865035 0.865035 0.750000 Ba\n0.706882 0.293118 0.500000 Ba\n0.293118 0.706882 0.500000 Ba\n0.293118 0.706882 0.000000 Ba\n0.134966 0.134966 0.250000 Ba\n0.706882 0.293118 0.000000 Ba\n0.416335 0.013059 0.750000 Pb\n0.986941 0.583666 0.250000 Pb\n0.196630 0.196630 0.553978 Pb\n0.196630 0.196630 0.946022 Pb\n0.536790 0.536790 0.250000 Pb\n0.803371 0.803371 0.446022 Pb\n0.463210 0.463211 0.750000 Pb\n0.583665 0.986942 0.250000 Pb\n0.013059 0.416335 0.750000 Pb\n0.803371 0.803371 0.053978 Pb\n",
"nsites": 16,
"nelements": 2,
"elements": [
"Ba",
"Pb"
],
"chemical_system": "Ba-Pb",
"density": 8.09940686613057,
"density_atomic": 0.026948291855876355,
"volume": 593.7296540192782,
"volume_molar": 22.347022186813703,
"formula_full": "Ba6 Pb10",
"formula_reduced": "Ba3Pb5",
"formula_anonymous": "A3B5",
"energy_above_hull": 0.2457789549999999,
"spacegroup": 63
}
]
}