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=-volume_molar&page=579",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-volume_molar&page=577",
"results": [
{
"id": "jvasp-91670",
"created_at": "2022-09-04T14:36:10.189939Z",
"updated_at": "2022-09-04T14:36:10.189961Z",
"structure_string": "Pb4 Se4\n1.0\n0.000000 4.377591 0.000000\n0.000000 -0.000000 4.377843\n12.384059 0.000000 0.000000\nPb Se\n4 4\ndirect\n0.250000 0.249647 0.625012 Pb\n0.250000 0.250352 0.125012 Pb\n0.750000 0.750352 0.374988 Pb\n0.750000 0.749647 0.874988 Pb\n0.250000 0.249759 0.875019 Se\n0.250000 0.250241 0.375019 Se\n0.750000 0.750240 0.124981 Se\n0.750000 0.749759 0.624981 Se\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Pb",
"Se"
],
"chemical_system": "Pb-Se",
"density": 8.008655971442222,
"density_atomic": 0.03370789318919947,
"volume": 237.33313604314267,
"volume_molar": 17.865669403300434,
"formula_full": "Pb4 Se4",
"formula_reduced": "PbSe",
"formula_anonymous": "AB",
"energy_above_hull": 0.2478770933333333,
"spacegroup": 225
},
{
"id": "jvasp-14756",
"created_at": "2022-09-04T14:35:42.413896Z",
"updated_at": "2022-09-04T14:35:42.413919Z",
"structure_string": "U1 Sb1\n1.0\n3.791312 0.000000 2.188916\n1.263770 3.574483 2.188916\n-0.000000 -0.000000 4.377830\nU Sb\n1 1\ndirect\n0.500000 0.500000 0.500001 U\n0.000000 0.000000 0.000000 Sb\n",
"nsites": 2,
"nelements": 2,
"elements": [
"U",
"Sb"
],
"chemical_system": "Sb-U",
"density": 10.070133214223127,
"density_atomic": 0.0337107442855646,
"volume": 59.3282658803955,
"volume_molar": 17.864158408922354,
"formula_full": "U1 Sb1",
"formula_reduced": "USb",
"formula_anonymous": "AB",
"energy_above_hull": 2.43729105,
"spacegroup": 225
},
{
"id": "jvasp-86671",
"created_at": "2022-09-04T14:36:08.036165Z",
"updated_at": "2022-09-04T14:36:08.036198Z",
"structure_string": "Dy10 Bi2 Au4\n1.0\n6.600231 -0.000000 -3.369087\n-1.719750 6.372245 -3.369087\n0.938587 1.225474 9.988401\nDy Bi Au\n10 2 4\ndirect\n0.503249 0.326428 0.329676 Dy\n0.673572 0.173571 0.670323 Dy\n-0.003249 0.496751 0.670323 Dy\n0.826428 0.003249 0.329677 Dy\n0.000000 0.000000 0.000000 Dy\n0.173572 -0.003249 0.670323 Dy\n0.326428 0.826427 0.329676 Dy\n0.496751 0.673571 0.670322 Dy\n0.003249 0.503248 0.329677 Dy\n0.500000 0.500000 -0.000000 Dy\n0.750000 0.749999 0.499999 Bi\n0.250000 0.250000 0.500000 Bi\n0.872016 0.372016 -0.000001 Au\n0.127984 0.627984 -0.000000 Au\n0.372016 0.127984 -0.000000 Au\n0.627984 0.872015 -0.000001 Au\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Dy",
"Bi",
"Au"
],
"chemical_system": "Au-Bi-Dy",
"density": 9.904628452593244,
"density_atomic": 0.0337128705562121,
"volume": 474.5961923747179,
"volume_molar": 17.863031716503684,
"formula_full": "Dy10 Bi2 Au4",
"formula_reduced": "Dy5BiAu2",
"formula_anonymous": "AB2C5",
"energy_above_hull": 1.2391502425,
"spacegroup": 140
},
{
"id": "jvasp-86071",
"created_at": "2022-09-04T14:36:00.090996Z",
"updated_at": "2022-09-04T14:36:00.091027Z",
"structure_string": "Dy10 Bi2 Au4\n1.0\n6.599942 -0.000000 -3.368939\n-1.719674 6.371966 -3.368939\n0.938922 1.225913 9.988701\nDy Bi Au\n10 2 4\ndirect\n0.503216 0.326437 0.329653 Dy\n0.673563 0.173563 0.670347 Dy\n-0.003216 0.496784 0.670347 Dy\n0.826436 0.003216 0.329652 Dy\n0.000000 0.000000 0.000000 Dy\n0.173563 -0.003216 0.670347 Dy\n0.326437 0.826437 0.329653 Dy\n0.496784 0.673563 0.670347 Dy\n0.003216 0.503216 0.329653 Dy\n0.500000 0.500000 0.000000 Dy\n0.750000 0.750000 0.500000 Bi\n0.250000 0.250000 0.500000 Bi\n0.872017 0.372017 -0.000000 Au\n0.127984 0.627984 0.000000 Au\n0.372017 0.127983 -0.000000 Au\n0.627984 0.872017 0.000000 Au\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Dy",
"Bi",
"Au"
],
"chemical_system": "Au-Bi-Dy",
"density": 9.904825842058838,
"density_atomic": 0.03371354242043545,
"volume": 474.58673432969204,
"volume_molar": 17.86267573101331,
"formula_full": "Dy10 Bi2 Au4",
"formula_reduced": "Dy5BiAu2",
"formula_anonymous": "AB2C5",
"energy_above_hull": 1.2391502425,
"spacegroup": 140
},
{
"id": "jvasp-38916",
"created_at": "2022-09-04T14:37:52.413470Z",
"updated_at": "2022-09-04T14:37:52.413496Z",
"structure_string": "Pr2 Cd1 Pb1\n1.0\n0.000000 3.900091 3.900091\n3.900091 0.000000 3.900091\n3.900091 3.900091 -0.000000\nPr Cd Pb\n2 1 1\ndirect\n0.500001 0.500001 0.500001 Pr\n0.000000 0.000000 0.000000 Pr\n0.249999 0.249999 0.249999 Cd\n0.750001 0.750001 0.750001 Pb\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Pr",
"Cd",
"Pb"
],
"chemical_system": "Cd-Pb-Pr",
"density": 8.417387023232688,
"density_atomic": 0.03371365003680236,
"volume": 118.64630485377693,
"volume_molar": 17.862618712082895,
"formula_full": "Pr2 Cd1 Pb1",
"formula_reduced": "Pr2CdPb",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.3137375675000001,
"spacegroup": 225
},
{
"id": "jvasp-107217",
"created_at": "2022-09-04T14:37:03.062480Z",
"updated_at": "2022-09-04T14:37:03.062510Z",
"structure_string": "Tb5 Mg1\n1.0\n5.396488 0.000660 3.725165\n1.955396 5.029762 3.725165\n0.000964 0.000660 6.557356\nTb Mg\n5 1\ndirect\n0.656488 0.343512 -0.000001 Tb\n0.000000 0.656487 0.343512 Tb\n0.343512 0.000000 0.656488 Tb\n0.833677 0.833677 0.833676 Tb\n0.166323 0.166323 0.166323 Tb\n0.500000 0.500000 0.500000 Mg\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Tb",
"Mg"
],
"chemical_system": "Mg-Tb",
"density": 7.64178405272362,
"density_atomic": 0.03371702164845488,
"volume": 177.95166081269093,
"volume_molar": 17.860832498163347,
"formula_full": "Tb5 Mg1",
"formula_reduced": "Tb5Mg",
"formula_anonymous": "AB5",
"energy_above_hull": 1.2315887555555556,
"spacegroup": 155
},
{
"id": "jvasp-29158",
"created_at": "2022-09-04T14:37:51.960686Z",
"updated_at": "2022-09-04T14:37:51.960707Z",
"structure_string": "Te2 Mo2 W2 Se2 S4\n1.0\n3.308397 0.000000 -0.000000\n-1.654198 2.865148 0.000005\n-0.000000 0.000074 37.545786\nTe Mo W Se S\n2 2 2 2 4\ndirect\n0.666648 0.333294 0.418605 Te\n0.666645 0.333289 0.520700 Te\n0.333310 0.666620 0.093940 Mo\n0.333311 0.666622 0.469657 Mo\n0.666692 0.333382 0.281768 W\n0.666688 0.333375 0.657552 W\n0.666647 0.333291 0.049285 Se\n0.666645 0.333288 0.138694 Se\n0.333353 0.666707 0.322677 S\n0.333352 0.666705 0.698375 S\n0.333358 0.666717 0.240850 S\n0.333352 0.666707 0.616647 S\n",
"nsites": 12,
"nelements": 5,
"elements": [
"Te",
"Mo",
"W",
"Se",
"S"
],
"chemical_system": "Mo-S-Se-Te-W",
"density": 5.136731544182218,
"density_atomic": 0.03371750004478461,
"volume": 355.89827193775443,
"volume_molar": 17.860579082082626,
"formula_full": "Te2 Mo2 W2 Se2 S4",
"formula_reduced": "TeMoWSeS2",
"formula_anonymous": "ABCDE2",
"energy_above_hull": 3.6087961722222217,
"spacegroup": 156
},
{
"id": "jvasp-38574",
"created_at": "2022-09-04T14:38:32.516429Z",
"updated_at": "2022-09-04T14:38:32.516451Z",
"structure_string": "Na1 Er3\n1.0\n0.000024 3.899832 3.899806\n3.899804 0.000026 3.899803\n3.899820 3.899847 0.000010\nNa Er\n1 3\ndirect\n0.749990 0.750003 0.749991 Na\n0.000010 0.000024 0.999961 Er\n0.499970 0.499984 0.500024 Er\n0.250032 0.249985 0.250024 Er\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Na",
"Er"
],
"chemical_system": "Er-Na",
"density": 7.346077862433108,
"density_atomic": 0.033720972840927364,
"volume": 118.62053977117688,
"volume_molar": 17.858739688230134,
"formula_full": "Na1 Er3",
"formula_reduced": "NaEr3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.92157725,
"spacegroup": 225
},
{
"id": "jvasp-70426",
"created_at": "2022-09-04T14:36:05.225862Z",
"updated_at": "2022-09-04T14:36:05.225892Z",
"structure_string": "Li2 Be1 Cl2\n1.0\n-2.417380 2.417380 6.343019\n2.417380 -2.417380 6.343019\n2.417380 2.417380 -6.343019\nLi Be Cl\n2 1 2\ndirect\n0.748279 0.748279 0.000000 Li\n0.251721 0.251721 0.000000 Li\n0.000000 0.000000 0.000000 Be\n0.750000 0.250000 0.500000 Cl\n0.250000 0.750000 0.500000 Cl\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Li",
"Be",
"Cl"
],
"chemical_system": "Be-Cl-Li",
"density": 1.0505262904189014,
"density_atomic": 0.03372284072524261,
"volume": 148.26746182913772,
"volume_molar": 17.857750505259887,
"formula_full": "Li2 Be1 Cl2",
"formula_reduced": "Li2BeCl2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 0.5788028470000002,
"spacegroup": 139
},
{
"id": "jvasp-29153",
"created_at": "2022-09-04T14:37:43.008842Z",
"updated_at": "2022-09-04T14:37:43.008864Z",
"structure_string": "Te2 Mo2 W2 Se2 S4\n1.0\n3.312465 0.000000 0.000000\n-1.656232 2.868696 -0.000007\n0.000000 -0.000102 37.447098\nTe Mo W Se S\n2 2 2 2 4\ndirect\n0.333360 0.666719 0.708872 Te\n0.333360 0.666720 0.606029 Te\n0.333312 0.666624 0.093988 Mo\n0.333265 0.666529 0.469620 Mo\n0.666693 0.333386 0.281789 W\n0.666695 0.333393 0.657479 W\n0.666638 0.333275 0.049240 Se\n0.666648 0.333296 0.138819 Se\n0.333364 0.666729 0.322876 S\n0.666655 0.333311 0.428819 S\n0.666655 0.333311 0.510465 S\n0.333358 0.666719 0.240751 S\n",
"nsites": 12,
"nelements": 5,
"elements": [
"Te",
"Mo",
"W",
"Se",
"S"
],
"chemical_system": "Mo-S-Se-Te-W",
"density": 5.137581865502585,
"density_atomic": 0.033723081552969526,
"volume": 355.83936720466534,
"volume_molar": 17.857622977131854,
"formula_full": "Te2 Mo2 W2 Se2 S4",
"formula_reduced": "TeMoWSeS2",
"formula_anonymous": "ABCDE2",
"energy_above_hull": 3.6154378388888886,
"spacegroup": 156
},
{
"id": "jvasp-16306",
"created_at": "2022-09-04T14:38:28.232867Z",
"updated_at": "2022-09-04T14:38:28.232878Z",
"structure_string": "Ca1 Te1\n1.0\n3.899726 0.000000 0.000000\n-0.000000 3.899726 0.000000\n-0.000000 -0.000000 3.899726\nCa Te\n1 1\ndirect\n0.000000 0.000000 0.000000 Ca\n0.500000 0.500000 0.500000 Te\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Ca",
"Te"
],
"chemical_system": "Ca-Te",
"density": 4.694862751740113,
"density_atomic": 0.03372311734351613,
"volume": 59.30649825836862,
"volume_molar": 17.857604024729532,
"formula_full": "Ca1 Te1",
"formula_reduced": "CaTe",
"formula_anonymous": "AB",
"energy_above_hull": 0.1618399999999999,
"spacegroup": 221
},
{
"id": "jvasp-56597",
"created_at": "2022-09-04T14:37:09.233467Z",
"updated_at": "2022-09-04T14:37:09.233488Z",
"structure_string": "Tb8 Bi6\n1.0\n7.674113 -0.000000 -2.713209\n-3.837056 6.645976 -2.713209\n0.000000 0.000000 8.139626\nTb Bi\n8 6\ndirect\n0.353440 0.500000 -0.000000 Tb\n0.853440 0.500000 -0.000000 Tb\n0.646559 0.646560 0.646560 Tb\n0.500000 0.000000 0.353440 Tb\n0.146560 0.146560 0.146560 Tb\n-0.000000 0.853441 0.500000 Tb\n0.500000 -0.000000 0.853440 Tb\n-0.000000 0.353440 0.500000 Tb\n0.875000 0.125000 0.750000 Bi\n0.749999 0.875001 0.125000 Bi\n0.250000 0.625000 0.375000 Bi\n0.625000 0.375000 0.250000 Bi\n0.125000 0.750000 0.875000 Bi\n0.375000 0.250000 0.625000 Bi\n",
"nsites": 14,
"nelements": 2,
"elements": [
"Tb",
"Bi"
],
"chemical_system": "Bi-Tb",
"density": 10.101087243125779,
"density_atomic": 0.03372380946097951,
"volume": 415.13696773191793,
"volume_molar": 17.857237531151345,
"formula_full": "Tb8 Bi6",
"formula_reduced": "Tb4Bi3",
"formula_anonymous": "A3B4",
"energy_above_hull": 1.262026642857143,
"spacegroup": 220
}
]
}