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=-id&page=1548",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-id&page=1546",
"results": [
{
"id": "jvasp-54890",
"created_at": "2022-09-04T14:37:03.839583Z",
"updated_at": "2022-09-04T14:37:03.839603Z",
"structure_string": "Rb2 W6 Cl18\n1.0\n4.653542 -8.060172 0.000000\n4.653544 8.060171 0.000000\n0.000000 0.000000 8.330429\nRb W Cl\n2 6 18\ndirect\n0.333333 0.666667 0.429093 Rb\n0.666667 0.333333 0.570907 Rb\n0.022623 0.827696 0.874102 W\n0.827695 0.805072 0.125898 W\n0.194927 0.022623 0.125898 W\n0.805072 0.977376 0.874102 W\n0.977376 0.172304 0.125898 W\n0.172304 0.194927 0.874102 W\n0.374984 0.421005 0.693633 Cl\n0.625016 0.578995 0.306367 Cl\n0.744458 0.172908 0.001126 Cl\n0.808524 0.783632 0.678518 Cl\n0.172908 0.428450 0.998875 Cl\n0.046021 0.625016 0.693633 Cl\n0.827091 0.571550 0.001126 Cl\n0.024893 0.808524 0.321482 Cl\n0.191475 0.216368 0.321482 Cl\n0.578995 0.953979 0.693633 Cl\n0.783631 0.975106 0.321482 Cl\n0.953979 0.374984 0.306367 Cl\n0.975106 0.191475 0.678518 Cl\n0.255541 0.827092 0.998875 Cl\n0.571550 0.744458 0.998875 Cl\n0.421005 0.046021 0.306367 Cl\n0.216368 0.024894 0.678518 Cl\n0.428450 0.255542 0.001126 Cl\n",
"nsites": 26,
"nelements": 3,
"elements": [
"Rb",
"W",
"Cl"
],
"chemical_system": "Cl-Rb-W",
"density": 5.080904653485428,
"density_atomic": 0.041605234214880556,
"volume": 624.9213708476329,
"volume_molar": 14.474478689140794,
"formula_full": "Rb2 W6 Cl18",
"formula_reduced": "Rb(WCl3)3",
"formula_anonymous": "AB3C9",
"energy_above_hull": 2.154628200576924,
"spacegroup": 147
},
{
"id": "jvasp-54888",
"created_at": "2022-09-04T14:37:17.659898Z",
"updated_at": "2022-09-04T14:37:17.659928Z",
"structure_string": "In4 Bi2\n1.0\n5.540091 0.000000 0.000000\n-2.770046 4.797861 -0.000000\n-0.000000 0.000000 6.752440\nIn Bi\n4 2\ndirect\n0.333332 0.666667 0.250000 In\n0.666667 0.333333 0.250000 In\n0.333332 0.666667 0.750000 In\n0.666667 0.333333 0.750000 In\n0.000000 0.000000 0.000000 Bi\n0.000000 0.000000 0.500000 Bi\n",
"nsites": 6,
"nelements": 2,
"elements": [
"In",
"Bi"
],
"chemical_system": "Bi-In",
"density": 8.115936962396361,
"density_atomic": 0.03342919790759852,
"volume": 179.48381581228992,
"volume_molar": 18.014613382725397,
"formula_full": "In4 Bi2",
"formula_reduced": "In2Bi",
"formula_anonymous": "AB2",
"energy_above_hull": 0.1186638111111111,
"spacegroup": 191
},
{
"id": "jvasp-54887",
"created_at": "2022-09-04T14:35:40.734823Z",
"updated_at": "2022-09-04T14:35:40.734846Z",
"structure_string": "Mn1 Sb1 Rh2\n1.0\n4.155308 0.000000 -0.000000\n0.000000 4.155308 -0.000000\n0.000000 0.000000 3.648795\nMn Sb Rh\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Mn\n0.500000 0.500000 0.000000 Sb\n0.000000 0.500000 0.499999 Rh\n0.500000 0.000000 0.499999 Rh\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Mn",
"Sb",
"Rh"
],
"chemical_system": "Mn-Rh-Sb",
"density": 10.081726283644553,
"density_atomic": 0.06348981870991365,
"volume": 63.00222746384088,
"volume_molar": 9.485207049519689,
"formula_full": "Mn1 Sb1 Rh2",
"formula_reduced": "MnSbRh2",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.8588223353448274,
"spacegroup": 123
},
{
"id": "jvasp-54886",
"created_at": "2022-09-04T14:37:14.623342Z",
"updated_at": "2022-09-04T14:37:14.623366Z",
"structure_string": "Ca6 Ga4 N8\n1.0\n5.580658 -0.007782 0.081648\n0.072894 6.580313 1.621912\n-0.011724 -0.007525 6.777628\nCa Ga N\n6 4 8\ndirect\n0.544829 0.749420 0.018494 Ca\n0.044830 0.018494 0.749421 Ca\n0.250000 0.601992 0.398008 Ca\n0.455171 0.250580 0.981506 Ca\n0.750000 0.398008 0.601992 Ca\n0.955170 0.981506 0.250580 Ca\n0.096462 0.583309 0.822096 Ga\n0.596462 0.822097 0.583309 Ga\n0.903538 0.416691 0.177904 Ga\n0.403538 0.177904 0.416691 Ga\n0.018265 0.709359 0.056842 N\n0.434923 0.574416 0.739778 N\n0.518266 0.056843 0.709359 N\n0.934923 0.739778 0.574416 N\n0.565077 0.425585 0.260222 N\n0.981736 0.290642 0.943158 N\n0.065077 0.260223 0.425585 N\n0.481735 0.943158 0.290641 N\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Ca",
"Ga",
"N"
],
"chemical_system": "Ca-Ga-N",
"density": 4.211304399429108,
"density_atomic": 0.07229797108203002,
"volume": 248.96964230956098,
"volume_molar": 8.3296123941946,
"formula_full": "Ca6 Ga4 N8",
"formula_reduced": "Ca3(GaN2)2",
"formula_anonymous": "A2B3C4",
"energy_above_hull": 2.320095434444444,
"spacegroup": 15
},
{
"id": "jvasp-54885",
"created_at": "2022-09-04T14:37:19.115195Z",
"updated_at": "2022-09-04T14:37:19.115209Z",
"structure_string": "Tl4 Pt2\n1.0\n4.907563 0.000000 2.830769\n2.453781 4.972801 1.415384\n-0.030898 0.000000 5.722949\nTl Pt\n4 2\ndirect\n0.659241 0.181515 0.500000 Tl\n0.840757 0.500000 0.818485 Tl\n0.340758 0.818485 0.500000 Tl\n0.159242 0.500000 0.181515 Tl\n0.250000 -0.000000 0.000000 Pt\n0.749999 -0.000000 0.000000 Pt\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Tl",
"Pt"
],
"chemical_system": "Pt-Tl",
"density": 14.31434135965687,
"density_atomic": 0.042826642178214296,
"volume": 140.09970651054616,
"volume_molar": 14.061669217353291,
"formula_full": "Tl4 Pt2",
"formula_reduced": "Tl2Pt",
"formula_anonymous": "AB2",
"energy_above_hull": 0.3751755333333332,
"spacegroup": 140
},
{
"id": "jvasp-54884",
"created_at": "2022-09-04T14:37:19.661553Z",
"updated_at": "2022-09-04T14:37:19.661576Z",
"structure_string": "Mg2 B4 H16\n1.0\n4.306414 0.000000 0.000000\n0.000000 5.334074 0.000000\n0.000000 0.000000 8.450067\nMg B H\n2 4 16\ndirect\n0.000000 0.716394 0.504380 Mg\n0.000000 0.283605 0.004379 Mg\n0.000000 0.527151 0.246233 B\n0.000000 0.472848 0.746233 B\n0.499999 0.055282 0.976933 B\n0.499999 0.944718 0.476932 B\n0.240398 0.524532 0.676218 H\n0.721794 -0.003306 0.563262 H\n0.000000 0.595546 0.870056 H\n0.721794 0.003306 0.063262 H\n0.499999 0.718083 0.444111 H\n0.000000 0.244815 0.763396 H\n0.240398 0.475467 0.176218 H\n0.000000 0.755184 0.263396 H\n0.278205 0.003306 0.063262 H\n0.759601 0.475467 0.176218 H\n0.000000 0.404454 0.370055 H\n0.499999 0.932985 0.856965 H\n0.499999 0.067014 0.356964 H\n0.278205 -0.003306 0.563262 H\n0.759601 0.524532 0.676218 H\n0.499999 0.281916 0.944111 H\n",
"nsites": 22,
"nelements": 3,
"elements": [
"Mg",
"B",
"H"
],
"chemical_system": "B-H-Mg",
"density": 0.9237652816753309,
"density_atomic": 0.1133411756936143,
"volume": 194.10421557184793,
"volume_molar": 5.3132859467411455,
"formula_full": "Mg2 B4 H16",
"formula_reduced": "Mg(BH4)2",
"formula_anonymous": "AB2C8",
"energy_above_hull": 3.133770383333333,
"spacegroup": 26
},
{
"id": "jvasp-54882",
"created_at": "2022-09-04T14:37:14.783088Z",
"updated_at": "2022-09-04T14:37:14.783114Z",
"structure_string": "Tb2 Fe17\n1.0\n6.208269 0.036009 0.801378\n0.709152 6.167738 0.801378\n0.040151 0.036009 6.259648\nTb Fe\n2 17\ndirect\n0.655674 0.655674 0.655674 Tb\n0.344326 0.344326 0.344326 Tb\n0.295623 0.704377 0.000000 Fe\n-0.000000 0.500000 0.000000 Fe\n0.846777 0.336521 0.336521 Fe\n0.336520 0.846777 0.336521 Fe\n0.663479 0.663480 0.153224 Fe\n-0.000000 0.000000 0.500000 Fe\n-0.000000 0.295623 0.704377 Fe\n0.336520 0.336521 0.846777 Fe\n0.295623 0.000000 0.704377 Fe\n-0.000000 0.704377 0.295623 Fe\n0.704377 0.295623 0.000000 Fe\n0.704377 0.000000 0.295623 Fe\n0.909528 0.909529 0.909529 Fe\n0.663479 0.153224 0.663480 Fe\n0.090472 0.090472 0.090472 Fe\n0.500000 0.000000 0.000000 Fe\n0.153223 0.663480 0.663480 Fe\n",
"nsites": 19,
"nelements": 2,
"elements": [
"Tb",
"Fe"
],
"chemical_system": "Fe-Tb",
"density": 8.798100740799825,
"density_atomic": 0.07944066830147924,
"volume": 239.17220746299043,
"volume_molar": 7.580677364326583,
"formula_full": "Tb2 Fe17",
"formula_reduced": "Tb2Fe17",
"formula_anonymous": "A2B17",
"energy_above_hull": 4.063990542105263,
"spacegroup": 166
},
{
"id": "jvasp-54881",
"created_at": "2022-09-04T14:37:13.965613Z",
"updated_at": "2022-09-04T14:37:13.965633Z",
"structure_string": "Hf1 Si2 Ni2\n1.0\n3.540312 0.000000 -1.279375\n-0.462332 3.509994 -1.279375\n-0.002897 -0.003303 5.530082\nHf Si Ni\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Hf\n0.380860 0.380861 0.761720 Si\n0.619139 0.619139 0.238278 Si\n0.250000 0.750000 0.499999 Ni\n0.749999 0.250000 0.499999 Ni\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Hf",
"Si",
"Ni"
],
"chemical_system": "Hf-Ni-Si",
"density": 8.51060437833223,
"density_atomic": 0.07279133335970371,
"volume": 68.68949597738694,
"volume_molar": 8.273156270185558,
"formula_full": "Hf1 Si2 Ni2",
"formula_reduced": "Hf(SiNi)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 2.805565,
"spacegroup": 139
},
{
"id": "jvasp-54880",
"created_at": "2022-09-04T14:37:15.780279Z",
"updated_at": "2022-09-04T14:37:15.780303Z",
"structure_string": "Sm6 Te8\n1.0\n7.707780 0.000000 -2.725112\n-3.853891 6.675134 -2.725112\n0.000000 -0.000000 8.175336\nSm Te\n6 8\ndirect\n0.125000 0.750000 0.875000 Sm\n0.625000 0.375000 0.250000 Sm\n0.375000 0.250000 0.625000 Sm\n0.750000 0.874999 0.125000 Sm\n0.250000 0.625000 0.375000 Sm\n0.875000 0.125000 0.750001 Sm\n0.646805 0.646804 0.646805 Te\n-0.000000 0.853195 0.500000 Te\n0.853195 0.500000 0.000000 Te\n-0.000000 0.353195 0.500000 Te\n0.500000 -0.000000 0.853196 Te\n0.500000 -0.000000 0.353195 Te\n0.353195 0.500000 0.000000 Te\n0.146805 0.146805 0.146805 Te\n",
"nsites": 14,
"nelements": 2,
"elements": [
"Sm",
"Te"
],
"chemical_system": "Sm-Te",
"density": 7.591444798994238,
"density_atomic": 0.03328381704973411,
"volume": 420.62483335612006,
"volume_molar": 18.093299668729273,
"formula_full": "Sm6 Te8",
"formula_reduced": "Sm3Te4",
"formula_anonymous": "A3B4",
"energy_above_hull": 1.1374896702380952,
"spacegroup": 220
},
{
"id": "jvasp-5488",
"created_at": "2022-09-04T14:38:35.773660Z",
"updated_at": "2022-09-04T14:38:35.773698Z",
"structure_string": "Ta4 Zn6 O16\n1.0\n5.793311 -0.239197 2.103182\n-0.154079 5.796200 2.103182\n-0.215390 -0.212250 9.584435\nTa Zn O\n4 6 16\ndirect\n0.223968 0.939338 0.872344 Ta\n0.776032 0.060662 0.127656 Ta\n0.939338 0.223967 0.372344 Ta\n0.060662 0.776032 0.627656 Ta\n0.365906 0.318716 0.494418 Zn\n0.681283 0.634093 0.005582 Zn\n0.634094 0.681283 0.505582 Zn\n0.318716 0.365906 0.994418 Zn\n0.762335 0.237665 0.750000 Zn\n0.237665 0.762335 0.250000 Zn\n0.985356 0.715807 0.855539 O\n0.284193 0.014644 0.644462 O\n0.141443 0.938601 0.395856 O\n0.820305 0.573962 0.645452 O\n0.938601 0.141443 0.895856 O\n0.715807 0.985356 0.355539 O\n0.014644 0.284193 0.144461 O\n0.420490 0.691629 0.908043 O\n0.308371 0.579511 0.591957 O\n0.579511 0.308371 0.091957 O\n0.691629 0.420490 0.408043 O\n0.573962 0.820305 0.145452 O\n0.179695 0.426037 0.354548 O\n0.426037 0.179695 0.854548 O\n0.858557 0.061399 0.604144 O\n0.061399 0.858557 0.104144 O\n",
"nsites": 26,
"nelements": 3,
"elements": [
"Ta",
"Zn",
"O"
],
"chemical_system": "O-Ta-Zn",
"density": 6.971053819249585,
"density_atomic": 0.0795415231040352,
"volume": 326.87329818909393,
"volume_molar": 7.57106543223145,
"formula_full": "Ta4 Zn6 O16",
"formula_reduced": "Ta2Zn3O8",
"formula_anonymous": "A2B3C8",
"energy_above_hull": 2.4612605846153848,
"spacegroup": 15
},
{
"id": "jvasp-54879",
"created_at": "2022-09-04T14:37:12.183087Z",
"updated_at": "2022-09-04T14:37:12.183112Z",
"structure_string": "Ti2 Cl6\n1.0\n3.100639 -5.370465 0.000000\n3.100639 5.370465 -0.000000\n-0.000000 0.000000 5.684908\nTi Cl\n2 6\ndirect\n0.000000 0.000000 0.000000 Ti\n0.000000 0.000000 0.500000 Ti\n0.685871 0.685871 0.250000 Cl\n0.000000 0.685871 0.750000 Cl\n0.314129 0.314129 0.750000 Cl\n0.000000 0.314129 0.250000 Cl\n0.685871 0.000000 0.750000 Cl\n0.314129 0.000000 0.250000 Cl\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Ti",
"Cl"
],
"chemical_system": "Cl-Ti",
"density": 2.7053294214614687,
"density_atomic": 0.04225454744035494,
"volume": 189.32873464785118,
"volume_molar": 14.25205362452561,
"formula_full": "Ti2 Cl6",
"formula_reduced": "TiCl3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.6128676339583332,
"spacegroup": 193
},
{
"id": "jvasp-54877",
"created_at": "2022-09-04T14:37:08.353699Z",
"updated_at": "2022-09-04T14:37:08.353726Z",
"structure_string": "Ti2 B1 Rh6\n1.0\n4.831280 -0.000000 2.789341\n1.610427 4.554975 2.789341\n0.000000 0.000000 5.578683\nTi B Rh\n2 1 6\ndirect\n0.250000 0.250000 0.250000 Ti\n0.750000 0.750001 0.749999 Ti\n0.500000 0.500000 0.499999 B\n0.241378 0.758623 0.758621 Rh\n0.241378 0.241378 0.758622 Rh\n0.758622 0.241378 0.758622 Rh\n0.758622 0.241378 0.241377 Rh\n0.241378 0.758623 0.241377 Rh\n0.758622 0.758623 0.241377 Rh\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Ti",
"B",
"Rh"
],
"chemical_system": "B-Rh-Ti",
"density": 9.792522474138858,
"density_atomic": 0.07330989875327207,
"volume": 122.76650429282307,
"volume_molar": 8.214635216272498,
"formula_full": "Ti2 B1 Rh6",
"formula_reduced": "Ti2BRh6",
"formula_anonymous": "AB2C6",
"energy_above_hull": 3.803500805555556,
"spacegroup": 225
}
]
}