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=-density_atomic&page=979",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-density_atomic&page=977",
"results": [
{
"id": "jvasp-106343",
"created_at": "2022-09-04T14:38:40.830831Z",
"updated_at": "2022-09-04T14:38:40.830851Z",
"structure_string": "Nb3 B4 W3\n1.0\n6.162525 0.002259 0.000000\n-0.068035 6.162150 0.000000\n0.000000 0.000000 3.230114\nNb B W\n3 4 3\ndirect\n0.498362 0.999792 0.000000 Nb\n0.000208 0.501638 0.000000 Nb\n0.825300 0.174701 0.499999 Nb\n0.390768 0.609232 0.000000 B\n0.605418 0.394582 0.000000 B\n0.113495 0.108154 0.000000 B\n0.891846 0.886505 0.000000 B\n0.176665 0.823335 0.499999 W\n0.672367 0.674430 0.499999 W\n0.325570 0.327633 0.499999 W\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Nb",
"B",
"W"
],
"chemical_system": "B-Nb-W",
"density": 11.824779645410977,
"density_atomic": 0.08152474185736044,
"volume": 122.6621485965141,
"volume_molar": 7.386887247722444,
"formula_full": "Nb3 B4 W3",
"formula_reduced": "Nb3B4W3",
"formula_anonymous": "A3B3C4",
"energy_above_hull": 6.915785853333333,
"spacegroup": 38
},
{
"id": "jvasp-42216",
"created_at": "2022-09-04T14:36:56.001862Z",
"updated_at": "2022-09-04T14:36:56.001892Z",
"structure_string": "Li4 Co4 O2 F12\n1.0\n5.303852 0.099438 0.082915\n0.966966 6.737850 -0.009268\n2.345760 2.485235 7.599997\nLi Co O F\n4 4 2 12\ndirect\n0.110605 0.444957 0.263012 Li\n0.580780 0.268358 0.320695 Li\n0.419221 0.731642 0.679305 Li\n0.889396 0.555042 0.736987 Li\n0.268716 0.007258 0.190687 Co\n0.752773 0.783618 0.297797 Co\n0.247227 0.216382 0.702202 Co\n0.731284 0.992741 0.809312 Co\n0.419589 0.864632 0.367383 O\n0.580412 0.135368 0.632616 O\n0.298133 0.081787 0.937764 F\n0.874938 0.261667 0.797217 F\n0.252858 0.496212 0.720503 F\n0.778128 0.682713 0.529320 F\n0.221873 0.317287 0.470679 F\n0.374011 0.280698 0.157122 F\n0.125063 0.738333 0.202782 F\n0.701868 0.918213 0.062236 F\n0.887546 0.069750 0.277154 F\n0.112455 0.930250 0.722845 F\n0.747143 0.503788 0.279497 F\n0.625989 0.719302 0.842877 F\n",
"nsites": 22,
"nelements": 4,
"elements": [
"Li",
"Co",
"O",
"F"
],
"chemical_system": "Co-F-Li-O",
"density": 3.2209381257827263,
"density_atomic": 0.08151899992964062,
"volume": 269.8757347242764,
"volume_molar": 7.38740755553642,
"formula_full": "Li4 Co4 O2 F12",
"formula_reduced": "Li2Co2OF6",
"formula_anonymous": "AB2C2D6",
"energy_above_hull": 0.8510906359090908,
"spacegroup": 2
},
{
"id": "jvasp-86845",
"created_at": "2022-09-04T14:35:45.088390Z",
"updated_at": "2022-09-04T14:35:45.088415Z",
"structure_string": "Na1 Li5 N2\n1.0\n3.590111 0.000000 0.000000\n0.000000 3.757556 -0.556829\n0.000000 -0.785845 7.391226\nNa Li N\n1 5 2\ndirect\n0.500000 0.743249 0.878152 Na\n0.000000 0.129469 0.648951 Li\n0.500000 0.930718 0.244426 Li\n0.500000 0.574849 0.538894 Li\n0.000000 0.489200 0.361773 Li\n0.000000 0.343714 0.072173 Li\n0.500000 0.408007 0.198273 N\n0.000000 0.624792 0.639358 N\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Na",
"Li",
"N"
],
"chemical_system": "Li-N-Na",
"density": 1.450235638271386,
"density_atomic": 0.08151869979465133,
"volume": 98.1369921276014,
"volume_molar": 7.387434754442844,
"formula_full": "Na1 Li5 N2",
"formula_reduced": "NaLi5N2",
"formula_anonymous": "AB2C5",
"energy_above_hull": 1.8547819375,
"spacegroup": 38
},
{
"id": "jvasp-69390",
"created_at": "2022-09-04T14:35:56.208332Z",
"updated_at": "2022-09-04T14:35:56.208363Z",
"structure_string": "Be2 Zn1 Ga1\n1.0\n-1.818037 1.818037 3.711416\n1.818037 -1.818037 3.711416\n1.818037 1.818037 -3.711416\nBe Zn Ga\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Be\n0.250000 0.750001 0.500001 Be\n0.750001 0.250000 0.500001 Zn\n0.500000 0.500000 0.000000 Ga\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Zn",
"Ga"
],
"chemical_system": "Be-Ga-Zn",
"density": 5.182974626999558,
"density_atomic": 0.08151826526800086,
"volume": 49.06875761952895,
"volume_molar": 7.387474132578146,
"formula_full": "Be2 Zn1 Ga1",
"formula_reduced": "Be2ZnGa",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.690377578125,
"spacegroup": 119
},
{
"id": "jvasp-71803",
"created_at": "2022-09-04T14:36:05.083451Z",
"updated_at": "2022-09-04T14:36:05.083469Z",
"structure_string": "Be1 Cu2 Mo1\n1.0\n-1.813468 1.813468 3.730185\n1.813468 -1.813468 3.730185\n1.813468 1.813468 -3.730185\nBe Cu Mo\n1 2 1\ndirect\n0.750000 0.250000 0.500001 Be\n0.000000 0.000000 0.000000 Cu\n0.499999 0.499999 0.000000 Cu\n0.250000 0.750000 0.500001 Mo\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Cu",
"Mo"
],
"chemical_system": "Be-Cu-Mo",
"density": 7.8525303863295415,
"density_atomic": 0.08151730919070535,
"volume": 49.06933312337648,
"volume_molar": 7.38756077670759,
"formula_full": "Be1 Cu2 Mo1",
"formula_reduced": "BeCu2Mo",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.813415725,
"spacegroup": 139
},
{
"id": "jvasp-23342",
"created_at": "2022-09-04T14:37:40.491431Z",
"updated_at": "2022-09-04T14:37:40.491460Z",
"structure_string": "Pu8 C12\n1.0\n6.440115 0.000000 -2.276925\n-3.220058 5.577304 -2.276925\n-0.000000 -0.000000 6.830774\nPu C\n8 12\ndirect\n0.098604 0.098604 0.098604 Pu\n-0.000001 0.901395 0.500000 Pu\n0.500000 0.000000 0.901395 Pu\n-0.000000 0.401395 0.500000 Pu\n0.500000 0.000000 0.401396 Pu\n0.401396 0.500000 0.000000 Pu\n0.598604 0.598604 0.598605 Pu\n0.901396 0.500000 0.000001 Pu\n0.786022 0.036021 0.750000 C\n0.036021 0.749999 0.786021 C\n0.750000 0.786021 0.036022 C\n0.713979 0.463978 0.250001 C\n0.250000 0.713978 0.463979 C\n0.963979 0.213978 0.750000 C\n0.213978 0.749999 0.963978 C\n0.536022 0.286021 0.250000 C\n0.286022 0.250000 0.536022 C\n0.750000 0.963978 0.213979 C\n0.250000 0.536021 0.286022 C\n0.463979 0.250000 0.713979 C\n",
"nsites": 20,
"nelements": 2,
"elements": [
"Pu",
"C"
],
"chemical_system": "C-Pu",
"density": 14.1866261206663,
"density_atomic": 0.08151586461751992,
"volume": 245.35101349708887,
"volume_molar": 7.387691694440646,
"formula_full": "Pu8 C12",
"formula_reduced": "Pu2C3",
"formula_anonymous": "A2B3",
"energy_above_hull": 7.27181,
"spacegroup": 220
},
{
"id": "jvasp-86243",
"created_at": "2022-09-04T14:36:01.345717Z",
"updated_at": "2022-09-04T14:36:01.345743Z",
"structure_string": "Na1 Li5 N2\n1.0\n3.589840 0.000000 0.000000\n0.000000 3.757860 -0.555604\n0.000000 -0.783620 7.390907\nNa Li N\n1 5 2\ndirect\n0.500000 0.743322 0.878109 Na\n0.000000 0.129247 0.648978 Li\n0.500000 0.930807 0.244378 Li\n0.500000 0.574591 0.538906 Li\n0.000000 0.489142 0.361778 Li\n0.000000 0.344157 0.072211 Li\n0.500000 0.408160 0.198280 N\n0.000000 0.624575 0.639363 N\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Na",
"Li",
"N"
],
"chemical_system": "Li-N-Na",
"density": 1.4501728577525121,
"density_atomic": 0.08151517086036233,
"volume": 98.141240649599,
"volume_molar": 7.387754569411487,
"formula_full": "Na1 Li5 N2",
"formula_reduced": "NaLi5N2",
"formula_anonymous": "AB2C5",
"energy_above_hull": 1.8547819375,
"spacegroup": 38
},
{
"id": "jvasp-116763",
"created_at": "2022-09-04T14:38:45.445295Z",
"updated_at": "2022-09-04T14:38:45.445323Z",
"structure_string": "Sr4 La2 Mn2 Co2 O14\n1.0\n5.423343 -0.002845 0.000209\n0.004811 10.011457 2.706499\n-0.000168 0.002919 5.423418\nSr La Mn Co O\n4 2 2 2 14\ndirect\n0.000036 0.002204 0.498810 Sr\n0.500068 0.002204 0.998915 Sr\n0.000040 0.363329 0.318211 Sr\n0.500036 0.363328 0.818415 Sr\n0.499962 0.637028 0.182023 La\n0.999610 0.637028 0.681235 La\n0.500039 0.192377 0.403831 Mn\n0.000064 0.192377 0.903735 Mn\n0.000001 0.810820 0.094537 Co\n0.499939 0.810820 0.594682 Co\n0.250066 0.193754 0.153077 O\n0.750065 0.193957 0.652978 O\n0.249964 0.799131 0.850447 O\n0.749958 0.799720 0.350154 O\n0.249917 0.799564 0.350287 O\n0.749921 0.799281 0.850432 O\n0.500165 0.609685 0.694674 O\n0.499919 0.002385 0.499257 O\n0.000017 0.395612 0.802322 O\n0.500067 0.395612 0.302022 O\n0.750063 0.193699 0.153108 O\n0.999806 0.609684 0.195663 O\n0.000205 0.002385 0.998248 O\n0.250062 0.194017 0.652948 O\n",
"nsites": 24,
"nelements": 5,
"elements": [
"Sr",
"La",
"Mn",
"Co",
"O"
],
"chemical_system": "Co-La-Mn-O-Sr",
"density": 6.091279965959938,
"density_atomic": 0.081514879074758,
"volume": 294.4247758496874,
"volume_molar": 7.387781014159443,
"formula_full": "Sr4 La2 Mn2 Co2 O14",
"formula_reduced": "Sr2LaMnCoO7",
"formula_anonymous": "ABCD2E7",
"energy_above_hull": 2.3393900217816093,
"spacegroup": 107
},
{
"id": "jvasp-9529",
"created_at": "2022-09-04T14:37:16.920404Z",
"updated_at": "2022-09-04T14:37:16.920440Z",
"structure_string": "Mg4 Ti4 O8\n1.0\n2.849096 0.000093 0.000082\n1.424407 8.402621 0.048337\n1.423901 1.693062 8.209003\nMg Ti O\n4 4 8\ndirect\n0.614688 0.967094 0.803639 Mg\n0.389471 0.052985 0.168159 Mg\n0.933257 0.259804 0.873766 Mg\n0.070927 0.760275 0.098040 Mg\n0.339603 0.845860 0.475058 Ti\n0.787290 0.616239 0.809286 Ti\n0.216884 0.403842 0.162500 Ti\n0.664518 0.174230 0.496742 Ti\n0.141225 0.332966 0.384620 O\n0.653114 0.587607 0.106311 O\n0.351057 0.432472 0.865498 O\n0.862912 0.687115 0.587167 O\n0.916800 0.880452 0.286045 O\n0.183787 0.787200 0.845343 O\n0.087337 0.139641 0.685755 O\n0.820380 0.232876 0.126453 O\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Mg",
"Ti",
"O"
],
"chemical_system": "Mg-O-Ti",
"density": 3.5250275276879988,
"density_atomic": 0.08151309949409218,
"volume": 196.28746912218242,
"volume_molar": 7.3879423029871,
"formula_full": "Mg4 Ti4 O8",
"formula_reduced": "MgTiO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.3214060958333331,
"spacegroup": 12
},
{
"id": "jvasp-96620",
"created_at": "2022-09-04T14:36:12.656843Z",
"updated_at": "2022-09-04T14:36:12.656868Z",
"structure_string": "Zn8 As4 H4 O20\n1.0\n8.337654 -0.000004 -0.000001\n-0.000004 8.627122 -0.000003\n0.000000 -0.000002 6.140007\nZn As H O\n8 4 4 20\ndirect\n0.500000 0.500000 0.747263 Zn\n-0.000000 0.000000 0.752738 Zn\n0.500000 0.500000 0.252738 Zn\n-0.000000 0.000000 0.247263 Zn\n0.634960 0.135669 0.500000 Zn\n0.365040 0.864332 0.500001 Zn\n0.134960 0.364332 0.000000 Zn\n0.865040 0.635669 0.000000 Zn\n0.748000 0.253501 0.000000 As\n0.252000 0.746499 0.000000 As\n0.247999 0.246500 0.500000 As\n0.752001 0.753502 0.500001 As\n0.781664 0.915585 0.000001 H\n0.218336 0.084415 0.000000 H\n0.718336 0.415585 0.500001 H\n0.281664 0.584415 0.500001 H\n0.394206 0.105876 0.500000 O\n0.769411 0.133781 0.223698 O\n0.230589 0.866220 0.223699 O\n0.730588 0.633780 0.723700 O\n0.269411 0.366220 0.723698 O\n0.230589 0.866219 0.776303 O\n0.769411 0.133782 0.776302 O\n0.605795 0.894124 0.500001 O\n0.105795 0.605876 0.000000 O\n0.432350 0.647859 0.000000 O\n0.890380 0.872039 0.000001 O\n0.109619 0.127962 0.000000 O\n0.390382 0.627963 0.500001 O\n0.609619 0.372039 0.500000 O\n0.932350 0.852141 0.500001 O\n0.067651 0.147859 0.500000 O\n0.730588 0.633780 0.276303 O\n0.567650 0.352141 0.000000 O\n0.894206 0.394125 0.000000 O\n0.269412 0.366219 0.276303 O\n",
"nsites": 36,
"nelements": 4,
"elements": [
"Zn",
"As",
"H",
"O"
],
"chemical_system": "As-H-O-Zn",
"density": 4.312464881214043,
"density_atomic": 0.08151242737379474,
"volume": 441.65044717553786,
"volume_molar": 7.388003221133427,
"formula_full": "Zn8 As4 H4 O20",
"formula_reduced": "Zn2AsHO5",
"formula_anonymous": "ABC2D5",
"energy_above_hull": 1.6573155611111112,
"spacegroup": 58
},
{
"id": "jvasp-99659",
"created_at": "2022-09-04T14:36:16.115679Z",
"updated_at": "2022-09-04T14:36:16.115724Z",
"structure_string": "Hf1 Nb1 B2\n1.0\n4.841184 0.005129 0.000000\n-3.646033 3.184892 0.000000\n-0.000000 0.000000 3.178861\nHf Nb B\n1 1 2\ndirect\n0.851899 0.148100 -0.000000 Hf\n0.141590 0.858409 0.500000 Nb\n0.557266 0.442734 -0.000000 B\n0.449244 0.550755 0.500000 B\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Hf",
"Nb",
"B"
],
"chemical_system": "B-Hf-Nb",
"density": 9.915159575857503,
"density_atomic": 0.08151090951265301,
"volume": 49.07318571116026,
"volume_molar": 7.388140797355694,
"formula_full": "Hf1 Nb1 B2",
"formula_reduced": "HfNbB2",
"formula_anonymous": "ABC2",
"energy_above_hull": 4.7906918916666665,
"spacegroup": 38
},
{
"id": "jvasp-42495",
"created_at": "2022-09-04T14:36:56.464199Z",
"updated_at": "2022-09-04T14:36:56.464216Z",
"structure_string": "Na4 Fe2 O4\n1.0\n2.818015 -0.000000 -0.000000\n-1.409007 5.135225 0.000000\n0.000000 -0.000000 8.478069\nNa Fe O\n4 2 4\ndirect\n0.147733 0.295467 0.670787 Na\n0.393611 0.787226 0.844463 Na\n0.852264 0.704534 0.170787 Na\n0.606386 0.212775 0.344463 Na\n0.121591 0.243183 0.003992 Fe\n0.878407 0.756818 0.503992 Fe\n0.279807 0.559618 0.408417 O\n0.482311 0.964625 0.587231 O\n0.720190 0.440383 0.908417 O\n0.517686 0.035376 0.087231 O\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Na",
"Fe",
"O"
],
"chemical_system": "Fe-Na-O",
"density": 3.6225236468118758,
"density_atomic": 0.08150800730953067,
"volume": 122.68733257119766,
"volume_molar": 7.388403862126851,
"formula_full": "Na4 Fe2 O4",
"formula_reduced": "Na2FeO2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 1.1755200999999995,
"spacegroup": 36
}
]
}