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=-chemical_system&page=4448",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-chemical_system&page=4446",
"results": [
{
"id": "jvasp-62958",
"created_at": "2022-09-04T14:36:13.854340Z",
"updated_at": "2022-09-04T14:36:13.854355Z",
"structure_string": "Ca2 Al2 B6 O14\n1.0\n3.997597 -5.896336 0.000000\n3.997597 5.896336 -0.000000\n0.000000 -0.000000 4.400076\nCa Al B O\n2 2 6 14\ndirect\n0.500000 0.000000 0.000000 Ca\n0.000000 0.500000 0.000000 Ca\n0.000000 0.000000 0.000000 Al\n0.500000 0.500000 0.000000 Al\n0.750001 0.750001 0.500001 B\n0.250000 0.250000 0.500001 B\n0.862908 0.137092 0.541852 B\n0.637093 0.362908 0.541852 B\n0.362908 0.637093 0.458149 B\n0.137092 0.862908 0.458149 B\n0.280358 0.426408 0.300527 O\n0.219643 0.073592 0.300527 O\n0.926408 0.780358 0.300527 O\n0.573593 0.719643 0.300527 O\n0.719643 0.573593 0.699474 O\n0.780358 0.926408 0.699474 O\n0.250000 0.750001 0.329316 O\n0.368317 0.631684 0.775885 O\n0.631684 0.368317 0.224116 O\n0.868317 0.131684 0.224116 O\n0.426408 0.280358 0.699474 O\n0.750001 0.250000 0.670685 O\n0.131684 0.868317 0.775885 O\n0.073592 0.219643 0.699474 O\n",
"nsites": 24,
"nelements": 4,
"elements": [
"Ca",
"Al",
"B",
"O"
],
"chemical_system": "Al-B-Ca-O",
"density": 3.3860558018375957,
"density_atomic": 0.1157017250326679,
"volume": 207.4299237390255,
"volume_molar": 5.204884160801987,
"formula_full": "Ca2 Al2 B6 O14",
"formula_reduced": "CaAlB3O7",
"formula_anonymous": "ABC3D7",
"energy_above_hull": 2.9627729558333336,
"spacegroup": 67
},
{
"id": "jvasp-96941",
"created_at": "2022-09-04T14:36:15.220258Z",
"updated_at": "2022-09-04T14:36:15.220285Z",
"structure_string": "Ca2 Al2 B6 O14\n1.0\n4.397857 0.000000 -0.000000\n0.000000 6.843360 -1.971377\n0.000000 -0.703465 7.086822\nCa Al B O\n2 2 6 14\ndirect\n0.000000 0.500000 -0.000000 Ca\n0.000000 0.000000 0.500000 Ca\n0.000000 0.500000 0.500000 Al\n0.000000 0.000000 0.000000 Al\n0.541943 0.137117 0.862883 B\n0.458058 0.637117 0.362883 B\n0.500000 0.250000 0.250000 B\n0.541943 0.362884 0.637116 B\n0.458058 0.862883 0.137116 B\n0.500000 0.750000 0.750000 B\n0.699718 0.926372 0.780263 O\n0.328954 0.750000 0.250000 O\n0.671047 0.250001 0.750000 O\n0.699718 0.280264 0.426371 O\n0.224051 0.131738 0.868263 O\n0.300283 0.780264 0.926371 O\n0.224051 0.368263 0.631737 O\n0.300283 0.073629 0.219737 O\n0.300283 0.719737 0.573628 O\n0.300283 0.426371 0.280263 O\n0.699718 0.219737 0.073629 O\n0.775949 0.868263 0.131737 O\n0.699718 0.573629 0.719736 O\n0.775949 0.631737 0.368262 O\n",
"nsites": 24,
"nelements": 4,
"elements": [
"Ca",
"Al",
"B",
"O"
],
"chemical_system": "Al-B-Ca-O",
"density": 3.3900273575309288,
"density_atomic": 0.11583743332327923,
"volume": 207.18691109997903,
"volume_molar": 5.198786426140335,
"formula_full": "Ca2 Al2 B6 O14",
"formula_reduced": "CaAlB3O7",
"formula_anonymous": "ABC3D7",
"energy_above_hull": 2.9632096225,
"spacegroup": 67
},
{
"id": "jvasp-25593",
"created_at": "2022-09-04T14:38:18.548430Z",
"updated_at": "2022-09-04T14:38:18.548450Z",
"structure_string": "Ca2 Al4 B4 O14\n1.0\n4.789528 -0.005649 15.138763\n2.332962 4.182929 15.138763\n-0.009633 -0.005649 15.878337\nCa Al B O\n2 4 4 14\ndirect\n0.000000 0.000000 0.000000 Ca\n0.500000 0.500000 0.500000 Ca\n0.286102 0.286102 0.286101 Al\n0.786102 0.786102 0.786101 Al\n0.713899 0.713898 0.713898 Al\n0.213898 0.213898 0.213898 Al\n0.634470 0.634469 0.634469 B\n0.865531 0.865531 0.865530 B\n0.365531 0.365531 0.365530 B\n0.134469 0.134469 0.134469 B\n0.250000 0.250000 0.250000 O\n0.436475 0.097746 0.872059 O\n0.902254 0.127941 0.563525 O\n0.597747 0.936474 0.372059 O\n0.063526 0.627941 0.402253 O\n0.936475 0.372059 0.597746 O\n0.372060 0.597746 0.936474 O\n0.127941 0.563526 0.902253 O\n0.563526 0.902254 0.127940 O\n0.627941 0.402253 0.063525 O\n0.402254 0.063525 0.627940 O\n0.872060 0.436474 0.097746 O\n0.097746 0.872059 0.436474 O\n0.750001 0.750000 0.749999 O\n",
"nsites": 24,
"nelements": 4,
"elements": [
"Ca",
"Al",
"B",
"O"
],
"chemical_system": "Al-B-Ca-O",
"density": 2.369088647152095,
"density_atomic": 0.07520190990908526,
"volume": 319.1408307184565,
"volume_molar": 8.00796252020782,
"formula_full": "Ca2 Al4 B4 O14",
"formula_reduced": "CaAl2B2O7",
"formula_anonymous": "AB2C2D7",
"energy_above_hull": 2.669811307222222,
"spacegroup": 167
},
{
"id": "jvasp-102349",
"created_at": "2022-09-04T14:36:40.023859Z",
"updated_at": "2022-09-04T14:36:40.023885Z",
"structure_string": "Al6 B2 C2\n1.0\n3.492372 -0.000000 0.000000\n-1.746185 3.024483 0.000000\n-0.000000 -0.000000 11.569204\nAl B C\n6 2 2\ndirect\n0.333332 0.666666 0.424415 Al\n0.666666 0.333333 0.575585 Al\n0.666666 0.333333 0.924415 Al\n0.333332 0.666666 0.075585 Al\n0.000000 0.000000 0.250000 Al\n0.000000 0.000000 0.750000 Al\n0.000000 0.000000 0.500000 B\n0.000000 0.000000 0.000000 B\n0.666666 0.333333 0.750000 C\n0.333332 0.666666 0.250000 C\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Al",
"B",
"C"
],
"chemical_system": "Al-B-C",
"density": 2.820073101346004,
"density_atomic": 0.08183232219787598,
"volume": 122.20110258901535,
"volume_molar": 7.359122408182508,
"formula_full": "Al6 B2 C2",
"formula_reduced": "Al3BC",
"formula_anonymous": "ABC3",
"energy_above_hull": 3.2745241966666665,
"spacegroup": 194
},
{
"id": "jvasp-119211",
"created_at": "2022-09-04T14:38:52.105454Z",
"updated_at": "2022-09-04T14:38:52.105491Z",
"structure_string": "Al8 B1 C5\n1.0\n3.375639 0.009679 16.709397\n1.679184 2.928373 16.709397\n0.016652 0.009679 17.046953\nAl B C\n8 1 5\ndirect\n0.352987 0.352988 0.352988 Al\n0.854461 0.854462 0.854464 Al\n0.145537 0.145538 0.145538 Al\n0.647012 0.647012 0.647013 Al\n0.434534 0.434534 0.434535 Al\n0.935420 0.935421 0.935422 Al\n0.064579 0.064579 0.064579 Al\n0.565465 0.565466 0.565467 Al\n0.499999 0.500000 0.500001 B\n0.390959 0.390960 0.390961 C\n0.893131 0.893132 0.893134 C\n0.106867 0.106867 0.106868 C\n0.609039 0.609040 0.609041 C\n0.000000 0.000000 0.000000 C\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Al",
"B",
"C"
],
"chemical_system": "Al-B-C",
"density": 2.8484038726308474,
"density_atomic": 0.0837582030716852,
"volume": 167.14780745735408,
"volume_molar": 7.189911601668315,
"formula_full": "Al8 B1 C5",
"formula_reduced": "Al8BC5",
"formula_anonymous": "AB5C8",
"energy_above_hull": 4.2367653559523815,
"spacegroup": 166
},
{
"id": "jvasp-15348",
"created_at": "2022-09-04T14:36:13.093602Z",
"updated_at": "2022-09-04T14:36:13.093626Z",
"structure_string": "Be1 Al1 B1\n1.0\n3.041989 -0.000000 1.756294\n1.013996 2.868015 1.756294\n0.000000 0.000000 3.512587\nBe Al B\n1 1 1\ndirect\n0.500001 0.500001 0.499999 Be\n0.000000 0.000000 0.000000 Al\n0.250000 0.250000 0.249999 B\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Be",
"Al",
"B"
],
"chemical_system": "Al-B-Be",
"density": 2.5361363990727157,
"density_atomic": 0.09789378202411558,
"volume": 30.64546019134256,
"volume_molar": 6.151709164241382,
"formula_full": "Be1 Al1 B1",
"formula_reduced": "BeAlB",
"formula_anonymous": "ABC",
"energy_above_hull": 2.330410494444444,
"spacegroup": 216
},
{
"id": "jvasp-10576",
"created_at": "2022-09-04T14:37:16.371529Z",
"updated_at": "2022-09-04T14:37:16.371550Z",
"structure_string": "Ba1 Al2 B2 O7\n1.0\n4.843418 0.003038 7.268412\n2.202124 4.313858 7.268412\n0.004960 0.003038 8.734328\nBa Al B O\n1 2 2 7\ndirect\n0.000000 0.000000 0.000000 Ba\n0.568622 0.568623 0.568622 Al\n0.431378 0.431379 0.431378 Al\n0.736651 0.736653 0.736651 B\n0.263348 0.263349 0.263348 B\n0.481869 0.960507 0.356314 O\n0.356314 0.481871 0.960507 O\n0.960506 0.356315 0.481870 O\n0.500000 0.500001 0.500000 O\n0.039493 0.518130 0.643686 O\n0.643686 0.039494 0.518129 O\n0.518129 0.643686 0.039493 O\n",
"nsites": 12,
"nelements": 4,
"elements": [
"Ba",
"Al",
"B",
"O"
],
"chemical_system": "Al-B-Ba-O",
"density": 2.9608078730944007,
"density_atomic": 0.06585399628317477,
"volume": 182.22128765579433,
"volume_molar": 9.144685364430366,
"formula_full": "Ba1 Al2 B2 O7",
"formula_reduced": "BaAl2B2O7",
"formula_anonymous": "AB2C2D7",
"energy_above_hull": 2.691605103055556,
"spacegroup": 155
},
{
"id": "jvasp-58253",
"created_at": "2022-09-04T14:37:44.899274Z",
"updated_at": "2022-09-04T14:37:44.899303Z",
"structure_string": "Ba2 Al2 B2 O6 F4\n1.0\n2.459984 -4.260816 0.000000\n2.459984 4.260817 -0.000000\n-0.000000 0.000000 9.419882\nBa Al B O F\n2 2 2 6 4\ndirect\n0.000000 0.000000 0.500000 Ba\n0.000000 0.000000 0.000000 Ba\n0.666666 0.333332 0.250000 Al\n0.333332 0.666666 0.750000 Al\n0.333332 0.666666 0.250000 B\n0.666666 0.333332 0.750000 B\n0.327111 0.383050 0.250000 O\n0.616948 0.944059 0.250000 O\n0.944059 0.327110 0.750000 O\n0.383051 0.055939 0.750000 O\n0.055939 0.672889 0.250000 O\n0.672888 0.616948 0.750000 O\n0.666666 0.333332 0.052240 F\n0.333332 0.666666 0.552240 F\n0.666666 0.333332 0.447760 F\n0.333332 0.666666 0.947760 F\n",
"nsites": 16,
"nelements": 5,
"elements": [
"Ba",
"Al",
"B",
"O",
"F"
],
"chemical_system": "Al-B-Ba-F-O",
"density": 4.391466618408819,
"density_atomic": 0.08102506929451453,
"volume": 197.46974781153583,
"volume_molar": 7.432441357267317,
"formula_full": "Ba2 Al2 B2 O6 F4",
"formula_reduced": "BaAlBO3F2",
"formula_anonymous": "ABCD2E3",
"energy_above_hull": 1.4456865522916669,
"spacegroup": 176
},
{
"id": "jvasp-24860",
"created_at": "2022-09-04T14:38:29.051373Z",
"updated_at": "2022-09-04T14:38:29.051400Z",
"structure_string": "Ba2 Al2 B2 O6 F4\n1.0\n2.460211 -4.261211 -0.000000\n2.460211 4.261211 0.000000\n0.000000 -0.000000 9.413785\nBa Al B O F\n2 2 2 6 4\ndirect\n0.000000 0.000000 0.749999 Ba\n0.000000 0.000000 0.250000 Ba\n0.666667 0.333333 0.000000 Al\n0.333333 0.666667 0.500000 Al\n0.333333 0.666667 0.000000 B\n0.666667 0.333333 0.500000 B\n0.944060 0.327132 0.500000 O\n0.055937 0.383069 0.000000 O\n0.383072 0.055940 0.500000 O\n0.327132 0.944062 0.000000 O\n0.616930 0.672868 0.000000 O\n0.672867 0.616928 0.500000 O\n0.666667 0.333333 0.802152 F\n0.333333 0.666667 0.697848 F\n0.333333 0.666667 0.302151 F\n0.666667 0.333333 0.197848 F\n",
"nsites": 16,
"nelements": 5,
"elements": [
"Ba",
"Al",
"B",
"O",
"F"
],
"chemical_system": "Al-B-Ba-F-O",
"density": 4.393498586142841,
"density_atomic": 0.08106256026069045,
"volume": 197.37841919309398,
"volume_molar": 7.42900389604436,
"formula_full": "Ba2 Al2 B2 O6 F4",
"formula_reduced": "BaAlBO3F2",
"formula_anonymous": "ABCD2E3",
"energy_above_hull": 1.4456453022916669,
"spacegroup": 190
},
{
"id": "jvasp-12921",
"created_at": "2022-09-04T14:37:08.396505Z",
"updated_at": "2022-09-04T14:37:08.396538Z",
"structure_string": "Ba2 Al4 Te8\n1.0\n8.585562 0.000000 0.000000\n0.000000 8.585562 -0.000000\n0.000000 0.000000 6.770951\nBa Al Te\n2 4 8\ndirect\n0.500000 0.500000 0.000000 Ba\n0.000000 0.000000 0.000000 Ba\n0.500000 0.000000 0.500000 Al\n0.000000 0.500000 0.500000 Al\n0.000000 0.500000 0.000000 Al\n0.500000 0.000000 0.000000 Al\n0.668799 0.831201 0.251378 Te\n0.331201 0.168799 0.251378 Te\n0.831201 0.668799 0.748622 Te\n0.668799 0.168799 0.748622 Te\n0.331201 0.831201 0.748622 Te\n0.168799 0.331201 0.748622 Te\n0.168799 0.668799 0.251378 Te\n0.831201 0.331201 0.251378 Te\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Ba",
"Al",
"Te"
],
"chemical_system": "Al-Ba-Te",
"density": 4.669144339844096,
"density_atomic": 0.02805051939119946,
"volume": 499.09949276705174,
"volume_molar": 21.468909990627054,
"formula_full": "Ba2 Al4 Te8",
"formula_reduced": "Ba(AlTe2)2",
"formula_anonymous": "AB2C4",
"energy_above_hull": 0.9687860909523808,
"spacegroup": 125
},
{
"id": "jvasp-100428",
"created_at": "2022-09-04T14:36:49.147887Z",
"updated_at": "2022-09-04T14:36:49.147919Z",
"structure_string": "Ba1 Al1 Sn1\n1.0\n4.676589 -0.000000 -0.000000\n-2.338294 4.050045 0.000000\n-0.000000 0.000000 5.156310\nBa Al Sn\n1 1 1\ndirect\n0.666667 0.333333 0.000000 Ba\n0.000000 0.000000 0.500000 Al\n0.333333 0.666666 0.500000 Sn\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ba",
"Al",
"Sn"
],
"chemical_system": "Al-Ba-Sn",
"density": 4.8121140253999775,
"density_atomic": 0.030718017449486764,
"volume": 97.66255276510769,
"volume_molar": 19.604587991080194,
"formula_full": "Ba1 Al1 Sn1",
"formula_reduced": "BaAlSn",
"formula_anonymous": "ABC",
"energy_above_hull": 0.3694201566666666,
"spacegroup": 187
},
{
"id": "jvasp-56571",
"created_at": "2022-09-04T14:38:36.531985Z",
"updated_at": "2022-09-04T14:38:36.532026Z",
"structure_string": "Ba5 Al5 Sn1\n1.0\n3.052835 -5.287666 -0.000000\n3.052835 5.287666 -0.000000\n-0.000000 -0.000000 11.125480\nBa Al Sn\n5 5 1\ndirect\n0.666668 0.333334 0.799975 Ba\n0.666668 0.333334 0.200025 Ba\n0.000000 0.000000 0.673202 Ba\n0.000000 0.000000 0.326798 Ba\n0.333334 0.666668 0.000000 Ba\n0.972325 0.486162 0.500000 Al\n0.333334 0.666668 0.676464 Al\n0.513840 0.486162 0.500000 Al\n0.513839 0.027677 0.500000 Al\n0.333334 0.666668 0.323536 Al\n0.000000 0.000000 0.000000 Sn\n",
"nsites": 11,
"nelements": 3,
"elements": [
"Ba",
"Al",
"Sn"
],
"chemical_system": "Al-Ba-Sn",
"density": 4.346879322526169,
"density_atomic": 0.03062503440406063,
"volume": 359.1832699636572,
"volume_molar": 19.664111003256576,
"formula_full": "Ba5 Al5 Sn1",
"formula_reduced": "Ba5Al5Sn",
"formula_anonymous": "AB5C5",
"energy_above_hull": 0.7998923227272727,
"spacegroup": 187
}
]
}