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=formula_anonymous&page=4192",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=formula_anonymous&page=4190",
"results": [
{
"id": "jvasp-17232",
"created_at": "2022-09-04T14:38:17.295278Z",
"updated_at": "2022-09-04T14:38:17.295295Z",
"structure_string": "Pr1 Mg1 Ni4\n1.0\n4.356772 0.000000 2.515384\n1.452257 4.107604 2.515384\n0.000000 -0.000000 5.030768\nPr Mg Ni\n1 1 4\ndirect\n0.000000 0.000000 0.000000 Pr\n0.250000 0.250000 0.250000 Mg\n0.623316 0.623315 0.623315 Ni\n0.623316 0.130052 0.623316 Ni\n0.623316 0.623315 0.130052 Ni\n0.130053 0.623315 0.623316 Ni\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Pr",
"Mg",
"Ni"
],
"chemical_system": "Mg-Ni-Pr",
"density": 7.377453297393827,
"density_atomic": 0.06664438423458581,
"volume": 90.03009134093307,
"volume_molar": 9.03623137817927,
"formula_full": "Pr1 Mg1 Ni4",
"formula_reduced": "PrMgNi4",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.8639847500000001,
"spacegroup": 216
},
{
"id": "jvasp-64532",
"created_at": "2022-09-04T14:38:07.068433Z",
"updated_at": "2022-09-04T14:38:07.068455Z",
"structure_string": "Ba4 Sb1 Cl1\n1.0\n0.000000 4.966721 4.966721\n4.966721 -0.000000 4.966721\n4.966721 4.966721 0.000000\nBa Sb Cl\n4 1 1\ndirect\n0.121895 0.626035 0.626035 Ba\n0.626035 0.626035 0.626035 Ba\n0.626035 0.121895 0.626035 Ba\n0.626035 0.626035 0.121895 Ba\n0.000000 0.000000 0.000000 Sb\n0.250000 0.250000 0.250000 Cl\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Sb",
"Cl"
],
"chemical_system": "Ba-Cl-Sb",
"density": 4.787787678569493,
"density_atomic": 0.024485668230076477,
"volume": 245.041301042788,
"volume_molar": 24.594553448220072,
"formula_full": "Ba4 Sb1 Cl1",
"formula_reduced": "Ba4SbCl",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.08827234125,
"spacegroup": 216
},
{
"id": "jvasp-9486",
"created_at": "2022-09-04T14:38:17.219300Z",
"updated_at": "2022-09-04T14:38:17.219321Z",
"structure_string": "Ti2 Zn2 F8\n1.0\n-5.146193 -0.000058 -0.000790\n-0.000117 -5.146594 -0.014789\n2.569037 2.554125 5.158957\nTi Zn F\n2 2 8\ndirect\n0.002041 0.499647 -0.001730 Ti\n0.502033 -0.000347 -0.001728 Ti\n0.752303 0.749808 0.498243 Zn\n0.251749 0.249410 0.498238 Zn\n0.665526 0.663208 0.753582 F\n0.909831 0.907376 0.243168 F\n0.338659 0.336200 0.243002 F\n0.409832 0.836277 0.243106 F\n0.094195 0.091846 0.753398 F\n0.165450 0.591879 0.753500 F\n0.594216 0.163170 0.753533 F\n0.838742 0.407348 0.243101 F\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Ti",
"Zn",
"F"
],
"chemical_system": "F-Ti-Zn",
"density": 4.607269647498569,
"density_atomic": 0.08795588241230955,
"volume": 136.43203468470443,
"volume_molar": 6.846774308704103,
"formula_full": "Ti2 Zn2 F8",
"formula_reduced": "TiZnF4",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.035909374074074,
"spacegroup": 140
},
{
"id": "jvasp-9678",
"created_at": "2022-09-04T14:38:04.824936Z",
"updated_at": "2022-09-04T14:38:04.824959Z",
"structure_string": "Nd2 Ta2 O8\n1.0\n4.848898 0.004869 -1.775062\n-1.338121 4.957321 -2.087937\n-0.006225 0.006400 6.716472\nNd Ta O\n2 2 8\ndirect\n0.381647 0.631647 0.263294 Nd\n0.618354 0.368353 0.736706 Nd\n0.849269 0.099269 0.198538 Ta\n0.150732 0.900731 0.801462 Ta\n0.997218 0.795141 0.062931 O\n0.565714 0.267790 0.062931 O\n0.002784 0.204859 0.937069 O\n0.434288 0.732210 0.937069 O\n0.197264 0.357401 0.413488 O\n0.716225 0.056087 0.413488 O\n0.802737 0.642599 0.586512 O\n0.283777 0.943913 0.586512 O\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Nd",
"Ta",
"O"
],
"chemical_system": "Nd-O-Ta",
"density": 8.002413170050392,
"density_atomic": 0.07429579987471635,
"volume": 161.51653283544132,
"volume_molar": 8.105627465018246,
"formula_full": "Nd2 Ta2 O8",
"formula_reduced": "NdTaO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.752935783333333,
"spacegroup": 15
},
{
"id": "jvasp-30059",
"created_at": "2022-09-04T14:38:10.017199Z",
"updated_at": "2022-09-04T14:38:10.017232Z",
"structure_string": "Cr4 P4 O16\n1.0\n4.716211 -0.029710 0.717254\n1.061227 4.595359 -0.717254\n0.613197 -0.775949 12.632070\nCr P O\n4 4 16\ndirect\n0.250056 0.750071 0.250008 Cr\n0.749945 0.249929 0.749991 Cr\n0.750071 0.250055 0.249992 Cr\n0.249930 0.749945 0.750008 Cr\n0.746403 0.753714 0.100122 P\n0.253598 0.246286 0.899878 P\n0.753715 0.746403 0.399878 P\n0.246286 0.253597 0.600122 P\n0.857332 0.009608 0.355009 O\n0.142669 -0.009608 0.644991 O\n-0.009607 0.142668 0.855009 O\n0.509467 0.357287 0.644987 O\n0.642713 0.490533 0.144987 O\n0.731361 0.768789 0.518481 O\n0.513040 0.986836 0.808813 O\n0.768790 0.731361 0.981519 O\n0.013165 0.486961 0.308813 O\n0.009608 0.857332 0.144991 O\n0.231211 0.268639 0.018481 O\n0.357288 0.509467 0.855013 O\n0.490534 0.642713 0.355013 O\n0.986836 0.513039 0.691187 O\n0.268640 0.231211 0.481519 O\n0.486961 0.013164 0.191187 O\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Cr",
"P",
"O"
],
"chemical_system": "Cr-O-P",
"density": 3.629658853790236,
"density_atomic": 0.08923737093258981,
"volume": 268.9456194101648,
"volume_molar": 6.748451570305836,
"formula_full": "Cr4 P4 O16",
"formula_reduced": "CrPO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.885641150000001,
"spacegroup": 12
},
{
"id": "jvasp-17868",
"created_at": "2022-09-04T14:38:15.992873Z",
"updated_at": "2022-09-04T14:38:15.992900Z",
"structure_string": "Tm1 In1 Ni4\n1.0\n4.290105 -0.000000 2.476893\n1.430035 4.044750 2.476893\n-0.000000 -0.000000 4.953787\nTm In Ni\n1 1 4\ndirect\n0.750002 0.750000 0.749999 Tm\n0.000000 0.000000 0.000000 In\n0.876919 0.374361 0.374360 Ni\n0.374362 0.374361 0.374360 Ni\n0.374362 0.374361 0.876917 Ni\n0.374362 0.876917 0.374360 Ni\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Tm",
"In",
"Ni"
],
"chemical_system": "In-Ni-Tm",
"density": 10.01665098298208,
"density_atomic": 0.06979982213516778,
"volume": 85.96010443093915,
"volume_molar": 8.627730810456923,
"formula_full": "Tm1 In1 Ni4",
"formula_reduced": "TmInNi4",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.8530523033333332,
"spacegroup": 216
},
{
"id": "jvasp-20928",
"created_at": "2022-09-04T14:38:05.178721Z",
"updated_at": "2022-09-04T14:38:05.178736Z",
"structure_string": "Sm4 P4 O16\n1.0\n0.000000 6.393439 0.018779\n6.917508 0.000000 0.000000\n0.000000 -4.760187 -6.530681\nSm P O\n4 4 16\ndirect\n0.183376 0.655223 0.781178 Sm\n0.816623 0.155223 0.718822 Sm\n0.816623 0.344777 0.218822 Sm\n0.183376 0.844777 0.281178 Sm\n0.688401 0.661245 0.801904 P\n0.311598 0.161245 0.698095 P\n0.311598 0.338755 0.198095 P\n0.688401 0.838755 0.301904 P\n0.119641 0.164793 0.117145 O\n0.880359 0.664793 0.382855 O\n0.812500 0.502958 0.750252 O\n0.187499 0.002958 0.749748 O\n0.187500 0.497042 0.249748 O\n0.812500 0.997042 0.250252 O\n0.659393 0.897584 0.472324 O\n0.407727 0.789804 0.120753 O\n0.340607 0.102417 0.527676 O\n0.659392 0.602417 0.972324 O\n0.119641 0.335207 0.617145 O\n0.592273 0.289804 0.379247 O\n0.592273 0.210196 0.879247 O\n0.407727 0.710197 0.620752 O\n0.340607 0.397584 0.027676 O\n0.880359 0.835207 0.882855 O\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Sm",
"P",
"O"
],
"chemical_system": "O-P-Sm",
"density": 5.653928149320108,
"density_atomic": 0.08327207144571717,
"volume": 288.2118768433058,
"volume_molar": 7.2318853793923825,
"formula_full": "Sm4 P4 O16",
"formula_reduced": "SmPO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.0868763958333334,
"spacegroup": 14
},
{
"id": "jvasp-11726",
"created_at": "2022-09-04T14:38:05.812711Z",
"updated_at": "2022-09-04T14:38:05.812735Z",
"structure_string": "Er2 V2 O8\n1.0\n5.685008 -0.005444 -1.671974\n-3.184177 4.709605 -1.671974\n0.002895 0.005444 5.925776\nEr V O\n2 2 8\ndirect\n0.124999 0.874999 0.250000 Er\n0.875000 0.125000 0.750001 Er\n0.374999 0.624999 0.750001 V\n0.625000 0.375000 0.250001 V\n0.801011 0.364480 0.063470 O\n0.737540 0.801010 0.936532 O\n0.364478 0.801010 0.563470 O\n0.801010 0.737541 0.436532 O\n0.262458 0.198989 0.063469 O\n0.198988 0.635519 0.936531 O\n0.198988 0.262458 0.563469 O\n0.635520 0.198989 0.436532 O\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Er",
"V",
"O"
],
"chemical_system": "Er-O-V",
"density": 5.907042699796463,
"density_atomic": 0.07563419305615031,
"volume": 158.65839926514826,
"volume_molar": 7.9621934427583625,
"formula_full": "Er2 V2 O8",
"formula_reduced": "ErVO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.300421366666667,
"spacegroup": 141
},
{
"id": "jvasp-65106",
"created_at": "2022-09-04T14:38:17.526598Z",
"updated_at": "2022-09-04T14:38:17.526608Z",
"structure_string": "Be1 Zn1 Si4\n1.0\n0.000000 3.594892 3.594892\n3.594892 -0.000000 3.594892\n3.594892 3.594892 -0.000000\nBe Zn Si\n1 1 4\ndirect\n0.000000 0.000000 0.000000 Be\n0.250000 0.250000 0.250000 Zn\n0.124016 0.625328 0.625328 Si\n0.625328 0.625328 0.625328 Si\n0.625328 0.124016 0.625328 Si\n0.625328 0.625328 0.124016 Si\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Be",
"Zn",
"Si"
],
"chemical_system": "Be-Si-Zn",
"density": 3.3377424620193903,
"density_atomic": 0.06457489549687359,
"volume": 92.91536523338998,
"volume_molar": 9.325823470038078,
"formula_full": "Be1 Zn1 Si4",
"formula_reduced": "BeZnSi4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.4915668166666665,
"spacegroup": 216
},
{
"id": "jvasp-10243",
"created_at": "2022-09-04T14:38:16.321365Z",
"updated_at": "2022-09-04T14:38:16.321375Z",
"structure_string": "Ce3 P3 O12\n1.0\n3.582825 -6.205634 0.000000\n3.582825 6.205634 -0.000000\n-0.000000 0.000000 6.464935\nCe P O\n3 3 12\ndirect\n0.000001 0.500000 0.666667 Ce\n0.500001 0.500001 0.333333 Ce\n0.500000 0.000001 0.000000 Ce\n0.000001 0.500000 0.166667 P\n0.500001 0.500001 0.833334 P\n0.500000 0.000001 0.500000 P\n0.862692 0.308864 0.019900 O\n0.137310 0.691138 0.019900 O\n0.308863 0.446172 0.686566 O\n0.446172 0.137309 0.353233 O\n0.553829 0.691138 0.980101 O\n0.862692 0.553830 0.313434 O\n0.137309 0.446172 0.313434 O\n0.691138 0.553829 0.686566 O\n0.691138 0.137310 0.646767 O\n0.446172 0.308863 0.980101 O\n0.553830 0.862692 0.353233 O\n0.308864 0.862692 0.646767 O\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Ce",
"P",
"O"
],
"chemical_system": "Ce-O-P",
"density": 4.073743894448281,
"density_atomic": 0.06261329988730596,
"volume": 287.4788588430438,
"volume_molar": 9.61798974153878,
"formula_full": "Ce3 P3 O12",
"formula_reduced": "CePO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.2287758333333336,
"spacegroup": 180
},
{
"id": "jvasp-108762",
"created_at": "2022-09-04T14:38:10.611034Z",
"updated_at": "2022-09-04T14:38:10.611061Z",
"structure_string": "La1 Pr1 C4\n1.0\n3.910358 -0.000000 0.000000\n0.000000 3.910358 0.000000\n-0.000000 -0.000000 6.540347\nLa Pr C\n1 1 4\ndirect\n0.500000 0.500000 0.500000 La\n0.000000 0.000000 0.000000 Pr\n0.000000 0.000000 0.598622 C\n0.500000 0.500000 0.098781 C\n0.500000 0.500000 0.901220 C\n0.000000 0.000000 0.401378 C\n",
"nsites": 6,
"nelements": 3,
"elements": [
"La",
"Pr",
"C"
],
"chemical_system": "C-La-Pr",
"density": 5.443751570805656,
"density_atomic": 0.05999532642239654,
"volume": 100.00778990278435,
"volume_molar": 10.037683131517904,
"formula_full": "La1 Pr1 C4",
"formula_reduced": "LaPrC4",
"formula_anonymous": "ABC4",
"energy_above_hull": 5.0713258083333335,
"spacegroup": 123
},
{
"id": "jvasp-46918",
"created_at": "2022-09-04T14:38:05.278987Z",
"updated_at": "2022-09-04T14:38:05.279007Z",
"structure_string": "Li2 V2 F8\n1.0\n-4.874034 -0.000000 -0.000000\n2.437018 3.325195 -4.381645\n0.000000 -2.175290 -4.361688\nLi V F\n2 2 8\ndirect\n0.874999 0.250001 0.875000 Li\n0.125000 0.750001 0.125000 Li\n0.625000 0.750001 0.625000 V\n0.375000 0.250000 0.375000 V\n0.988176 0.061106 0.696786 F\n0.572929 0.061106 0.242109 F\n0.696785 0.438895 0.572930 F\n0.757890 0.561106 0.011823 F\n0.303214 0.561106 0.427070 F\n0.242109 0.438895 0.988177 F\n0.427070 0.938896 0.757891 F\n0.011824 0.938896 0.303214 F\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Li",
"V",
"F"
],
"chemical_system": "F-Li-V",
"density": 3.795359411682202,
"density_atomic": 0.10243584822626978,
"volume": 117.1464893178147,
"volume_molar": 5.878938735097638,
"formula_full": "Li2 V2 F8",
"formula_reduced": "LiVF4",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.3271342216666666,
"spacegroup": 88
}
]
}