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=4123",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-id&page=4121",
"results": [
{
"id": "jvasp-109137",
"created_at": "2022-09-04T14:38:03.323186Z",
"updated_at": "2022-09-04T14:38:03.323207Z",
"structure_string": "Ti2 C1\n1.0\n2.934872 -0.002004 4.189105\n1.319955 2.621297 4.189105\n-0.003255 -0.002004 5.114887\nTi C\n2 1\ndirect\n0.246353 0.246356 0.246356 Ti\n0.753641 0.753648 0.753648 Ti\n0.499997 0.500002 0.500002 C\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Ti",
"C"
],
"chemical_system": "C-Ti",
"density": 4.539524738002005,
"density_atomic": 0.07611787020205404,
"volume": 39.4125583392774,
"volume_molar": 7.911599134361345,
"formula_full": "Ti2 C1",
"formula_reduced": "Ti2C",
"formula_anonymous": "AB2",
"energy_above_hull": 3.823288888888889,
"spacegroup": 166
},
{
"id": "jvasp-109136",
"created_at": "2022-09-04T14:38:00.655787Z",
"updated_at": "2022-09-04T14:38:00.655810Z",
"structure_string": "Tm1 U1 Te6\n1.0\n12.760095 0.078537 0.000000\n-12.027232 4.262848 0.000000\n0.000000 0.000000 4.372525\nTm U Te\n1 1 6\ndirect\n0.168195 0.831806 0.500001 Tm\n0.833394 0.166606 -0.000000 U\n0.425404 0.574597 -0.000000 Te\n0.573386 0.426615 0.500001 Te\n0.706341 0.293660 -0.000000 Te\n0.295051 0.704950 0.500001 Te\n0.072901 0.927100 -0.000000 Te\n0.925331 0.074670 0.500001 Te\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Tm",
"U",
"Te"
],
"chemical_system": "Te-Tm-U",
"density": 8.046782882245,
"density_atomic": 0.03306183411177677,
"volume": 241.97084689715888,
"volume_molar": 18.21478124788875,
"formula_full": "Tm1 U1 Te6",
"formula_reduced": "TmUTe6",
"formula_anonymous": "ABC6",
"energy_above_hull": 1.7770896062500006,
"spacegroup": 38
},
{
"id": "jvasp-109135",
"created_at": "2022-09-04T14:37:57.887287Z",
"updated_at": "2022-09-04T14:37:57.887313Z",
"structure_string": "Ti1 Nb3 Al2 C2\n1.0\n3.113150 0.000000 0.000000\n-1.556575 2.696067 0.000000\n-0.000000 -0.000000 13.896161\nTi Nb Al C\n1 3 2 2\ndirect\n0.666666 0.333334 0.413749 Ti\n0.333333 0.666668 0.587660 Nb\n0.333333 0.666668 0.910054 Nb\n0.666666 0.333334 0.091410 Nb\n0.666666 0.333334 0.749047 Al\n0.333333 0.666668 0.252843 Al\n0.000000 0.000000 0.494382 C\n0.000000 0.000000 0.000855 C\n",
"nsites": 8,
"nelements": 4,
"elements": [
"Ti",
"Nb",
"Al",
"C"
],
"chemical_system": "Al-C-Nb-Ti",
"density": 5.759938826047854,
"density_atomic": 0.06859057166633302,
"volume": 116.63410590768875,
"volume_molar": 8.779837539910615,
"formula_full": "Ti1 Nb3 Al2 C2",
"formula_reduced": "TiNb3(AlC)2",
"formula_anonymous": "AB2C2D3",
"energy_above_hull": 5.130760266666666,
"spacegroup": 156
},
{
"id": "jvasp-109134",
"created_at": "2022-09-04T14:38:26.700014Z",
"updated_at": "2022-09-04T14:38:26.700325Z",
"structure_string": "U1 Hg3\n1.0\n3.168160 0.000000 0.000000\n-1.584080 2.743707 0.000000\n-0.000000 -0.000000 10.855311\nU Hg\n1 3\ndirect\n0.333334 0.666667 0.500000 U\n0.333334 0.666667 -0.000000 Hg\n0.000000 0.000000 0.751946 Hg\n0.000000 0.000000 0.248054 Hg\n",
"nsites": 4,
"nelements": 2,
"elements": [
"U",
"Hg"
],
"chemical_system": "Hg-U",
"density": 14.778736165889907,
"density_atomic": 0.04239092402568044,
"volume": 94.35982092715881,
"volume_molar": 14.2062030927936,
"formula_full": "U1 Hg3",
"formula_reduced": "UHg3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.30079495,
"spacegroup": 187
},
{
"id": "jvasp-109133",
"created_at": "2022-09-04T14:38:27.264470Z",
"updated_at": "2022-09-04T14:38:27.264491Z",
"structure_string": "V1 Ga2 Fe1 Co4\n1.0\n3.876943 0.000424 5.826903\n1.761664 3.453582 5.826903\n0.000693 0.000424 6.998821\nV Ga Fe Co\n1 2 1 4\ndirect\n0.499999 0.499998 0.500001 V\n0.250221 0.250221 0.250222 Ga\n0.749778 0.749776 0.749780 Ga\n0.000000 0.000000 0.000000 Fe\n0.624735 0.624734 0.624737 Co\n0.125552 0.125552 0.125553 Co\n0.874447 0.874445 0.874450 Co\n0.375264 0.375263 0.375265 Co\n",
"nsites": 8,
"nelements": 4,
"elements": [
"V",
"Ga",
"Fe",
"Co"
],
"chemical_system": "Co-Fe-Ga-V",
"density": 8.542674564833714,
"density_atomic": 0.0853923564188337,
"volume": 93.68520012214536,
"volume_molar": 7.0523182783041065,
"formula_full": "V1 Ga2 Fe1 Co4",
"formula_reduced": "VGa2FeCo4",
"formula_anonymous": "ABC2D4",
"energy_above_hull": 2.88832724375,
"spacegroup": 166
},
{
"id": "jvasp-109131",
"created_at": "2022-09-04T14:38:20.101921Z",
"updated_at": "2022-09-04T14:38:20.101943Z",
"structure_string": "Yb1 Ga1 Co1 O4\n1.0\n3.375458 0.021935 7.771981\n1.632530 2.954496 7.771981\n0.036907 0.021935 8.473255\nYb Ga Co O\n1 1 1 4\ndirect\n0.998487 0.998492 0.998483 Yb\n0.784918 0.784923 0.784915 Ga\n0.213786 0.213787 0.213785 Co\n0.711941 0.711945 0.711938 O\n0.284169 0.284170 0.284168 O\n0.868344 0.868349 0.868341 O\n0.133551 0.133551 0.133550 O\n",
"nsites": 7,
"nelements": 4,
"elements": [
"Yb",
"Ga",
"Co",
"O"
],
"chemical_system": "Co-Ga-O-Yb",
"density": 7.31095261510292,
"density_atomic": 0.0842762727957646,
"volume": 83.06015166289832,
"volume_molar": 7.145713212298883,
"formula_full": "Yb1 Ga1 Co1 O4",
"formula_reduced": "YbGaCoO4",
"formula_anonymous": "ABCD4",
"energy_above_hull": 1.6082368464285717,
"spacegroup": 160
},
{
"id": "jvasp-10913",
"created_at": "2022-09-04T14:37:18.414536Z",
"updated_at": "2022-09-04T14:37:18.414554Z",
"structure_string": "Ca2 Bi2 As2 O12\n1.0\n0.000000 7.048916 0.133852\n5.164633 0.000000 0.000000\n0.000000 -1.873016 -7.247867\nCa Bi As O\n2 2 2 12\ndirect\n0.243246 0.775456 0.067616 Ca\n0.756755 0.275456 0.932385 Ca\n0.594303 0.220629 0.412951 Bi\n0.405698 0.720628 0.587049 Bi\n0.786470 0.804081 0.223127 As\n0.213530 0.304081 0.776874 As\n0.431115 0.484594 0.870567 O\n0.077019 0.372208 0.926498 O\n0.316175 0.999340 0.367466 O\n0.765448 0.472234 0.231351 O\n0.607141 0.023192 0.683059 O\n0.147049 0.460237 0.561929 O\n0.683825 0.499341 0.632535 O\n0.922982 0.872208 0.073503 O\n0.568885 0.984594 0.129433 O\n0.392860 0.523192 0.316942 O\n0.234552 0.972234 0.768650 O\n0.852951 0.960236 0.438072 O\n",
"nsites": 18,
"nelements": 4,
"elements": [
"Ca",
"Bi",
"As",
"O"
],
"chemical_system": "As-Bi-Ca-O",
"density": 5.312126144584036,
"density_atomic": 0.0685546479510628,
"volume": 262.5642540364172,
"volume_molar": 8.784438313065015,
"formula_full": "Ca2 Bi2 As2 O12",
"formula_reduced": "CaBiAsO6",
"formula_anonymous": "ABCD6",
"energy_above_hull": 2.0939597188888888,
"spacegroup": 4
},
{
"id": "jvasp-109127",
"created_at": "2022-09-04T14:38:19.493420Z",
"updated_at": "2022-09-04T14:38:19.493433Z",
"structure_string": "Yb1 Zn1 Cu1 Si2\n1.0\n3.809380 -0.005012 -4.394866\n-0.533945 3.771777 -4.394866\n0.004358 0.005012 5.816030\nYb Zn Cu Si\n1 1 1 2\ndirect\n0.000000 0.000000 0.000000 Yb\n0.249999 0.750000 0.499999 Zn\n0.750000 0.250000 0.500000 Cu\n0.614976 0.614978 -0.000001 Si\n0.385023 0.385023 -0.000001 Si\n",
"nsites": 5,
"nelements": 4,
"elements": [
"Yb",
"Zn",
"Cu",
"Si"
],
"chemical_system": "Cu-Si-Yb-Zn",
"density": 7.104196753661613,
"density_atomic": 0.05972436363595371,
"volume": 83.71792842326795,
"volume_molar": 10.083222982010488,
"formula_full": "Yb1 Zn1 Cu1 Si2",
"formula_reduced": "YbZnCuSi2",
"formula_anonymous": "ABCD2",
"energy_above_hull": 0.65521575,
"spacegroup": 119
},
{
"id": "jvasp-109126",
"created_at": "2022-09-04T14:38:12.813495Z",
"updated_at": "2022-09-04T14:38:12.813522Z",
"structure_string": "Zn1 Cd1 Se2\n1.0\n4.035668 0.008968 6.128523\n1.843280 3.590127 6.128523\n0.014648 0.008968 7.337928\nZn Cd Se\n1 1 2\ndirect\n0.499463 0.499464 0.499462 Zn\n0.001880 0.001880 0.001880 Cd\n0.130213 0.130213 0.130212 Se\n0.618444 0.618446 0.618443 Se\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Zn",
"Cd",
"Se"
],
"chemical_system": "Cd-Se-Zn",
"density": 5.2718199147826255,
"density_atomic": 0.037824080060956076,
"volume": 105.75273723918012,
"volume_molar": 15.921446735240911,
"formula_full": "Zn1 Cd1 Se2",
"formula_reduced": "ZnCdSe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 160
},
{
"id": "jvasp-109125",
"created_at": "2022-09-04T14:38:10.204106Z",
"updated_at": "2022-09-04T14:38:10.204128Z",
"structure_string": "Zn1 Ga1 P1 S1\n1.0\n3.706157 0.002453 5.599429\n1.687050 3.299920 5.599429\n0.004006 0.002453 6.714849\nZn Ga P S\n1 1 1 1\ndirect\n0.001775 0.001775 0.001775 Zn\n0.498840 0.498838 0.498838 Ga\n0.125862 0.125861 0.125861 P\n0.623527 0.623525 0.623526 S\n",
"nsites": 4,
"nelements": 4,
"elements": [
"Zn",
"Ga",
"P",
"S"
],
"chemical_system": "Ga-P-S-Zn",
"density": 4.013382208120578,
"density_atomic": 0.0487844974615056,
"volume": 81.99326032119694,
"volume_molar": 12.34437387563927,
"formula_full": "Zn1 Ga1 P1 S1",
"formula_reduced": "ZnGaPS",
"formula_anonymous": "ABCD",
"energy_above_hull": 0.55038455625,
"spacegroup": 160
},
{
"id": "jvasp-109124",
"created_at": "2022-09-04T14:38:19.825247Z",
"updated_at": "2022-09-04T14:38:19.825258Z",
"structure_string": "Zr4 Cu1 Ni1\n1.0\n5.166854 -0.019715 -1.255805\n-3.196243 4.059655 -1.255805\n0.009617 0.019715 5.317267\nZr Cu Ni\n4 1 1\ndirect\n0.409855 0.909854 0.819712 Zr\n0.090145 0.590144 0.180291 Zr\n0.590145 0.409854 0.500001 Zr\n0.909854 0.090144 0.500001 Zr\n0.499999 0.499999 0.000000 Cu\n0.000000 0.000000 0.000000 Ni\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Zr",
"Cu",
"Ni"
],
"chemical_system": "Cu-Ni-Zr",
"density": 7.257745123376085,
"density_atomic": 0.05383369315588061,
"volume": 111.45436339703512,
"volume_molar": 11.186564411552288,
"formula_full": "Zr4 Cu1 Ni1",
"formula_reduced": "Zr4CuNi",
"formula_anonymous": "ABC4",
"energy_above_hull": 3.2593618083333338,
"spacegroup": 97
},
{
"id": "jvasp-109123",
"created_at": "2022-09-04T14:38:18.650596Z",
"updated_at": "2022-09-04T14:38:18.650617Z",
"structure_string": "Zr5 Co4 Ni1\n1.0\n3.171312 -0.000000 0.000000\n0.000000 3.171312 0.000000\n-0.000000 -0.000000 15.893481\nZr Co Ni\n5 4 1\ndirect\n0.500000 0.500000 0.102783 Zr\n0.500000 0.500000 0.301506 Zr\n0.500000 0.500000 0.500000 Zr\n0.500000 0.500000 0.698494 Zr\n0.500000 0.500000 0.897217 Zr\n0.000000 0.000000 0.203133 Co\n0.000000 0.000000 0.401102 Co\n0.000000 0.000000 0.598898 Co\n0.000000 0.000000 0.796867 Co\n0.000000 0.000000 0.000000 Ni\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Zr",
"Co",
"Ni"
],
"chemical_system": "Co-Ni-Zr",
"density": 7.79703614540247,
"density_atomic": 0.06256090623850499,
"volume": 159.84423182548463,
"volume_molar": 9.626044637271402,
"formula_full": "Zr5 Co4 Ni1",
"formula_reduced": "Zr5Co4Ni",
"formula_anonymous": "AB4C5",
"energy_above_hull": 4.24482285,
"spacegroup": 123
}
]
}