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=-nsites&page=884",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-nsites&page=882",
"results": [
{
"id": "jvasp-12330",
"created_at": "2022-09-04T14:38:16.467696Z",
"updated_at": "2022-09-04T14:38:16.467744Z",
"structure_string": "Mn4 Ge4 N8\n1.0\n5.312905 0.000000 0.000000\n0.000000 5.554959 0.000000\n0.000000 0.000000 6.681230\nMn Ge N\n4 4 8\ndirect\n0.998426 0.581239 0.875757 Mn\n0.498426 0.918761 0.375757 Mn\n0.498426 0.418761 0.124243 Mn\n0.998426 0.081239 0.624243 Mn\n0.000825 0.072430 0.125481 Ge\n0.500825 0.927570 0.874519 Ge\n0.500825 0.427570 0.625481 Ge\n0.000825 0.572430 0.374519 Ge\n0.397218 0.601897 0.855591 N\n0.897219 0.398103 0.144409 N\n0.897219 0.898103 0.355591 N\n0.397218 0.101897 0.644409 N\n0.356532 0.561760 0.393439 N\n0.356532 0.061760 0.106561 N\n0.856533 0.938240 0.893439 N\n0.856533 0.438240 0.606561 N\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Mn",
"Ge",
"N"
],
"chemical_system": "Ge-Mn-N",
"density": 5.241136519768572,
"density_atomic": 0.08114292370079941,
"volume": 197.18293685099704,
"volume_molar": 7.421646257418096,
"formula_full": "Mn4 Ge4 N8",
"formula_reduced": "MnGeN2",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.811119922844827,
"spacegroup": 33
},
{
"id": "jvasp-37458",
"created_at": "2022-09-04T14:38:28.727363Z",
"updated_at": "2022-09-04T14:38:28.727389Z",
"structure_string": "Yb10 Sn6\n1.0\n9.238505 -0.000051 0.000000\n-4.619296 8.000814 0.000000\n0.000000 0.000000 6.640898\nYb Sn\n10 6\ndirect\n0.333329 0.666670 0.000000 Yb\n0.666669 0.333330 0.500000 Yb\n0.666669 0.333330 -0.000000 Yb\n0.333329 0.666670 0.500000 Yb\n0.274489 0.000010 0.250000 Yb\n0.725510 0.999990 0.750000 Yb\n0.000010 0.274487 0.250000 Yb\n0.725546 0.725546 0.250000 Yb\n0.274452 0.274453 0.750000 Yb\n0.999989 0.725512 0.750000 Yb\n0.617532 0.000005 0.250000 Sn\n0.382467 0.999994 0.750000 Sn\n0.000005 0.617531 0.250000 Sn\n0.382502 0.382502 0.250000 Sn\n0.617497 0.617497 0.750000 Sn\n-0.000006 0.382468 0.750000 Sn\n",
"nsites": 16,
"nelements": 2,
"elements": [
"Yb",
"Sn"
],
"chemical_system": "Sn-Yb",
"density": 8.263248626223469,
"density_atomic": 0.03259557785639668,
"volume": 490.86413103304125,
"volume_molar": 18.475330569475364,
"formula_full": "Yb10 Sn6",
"formula_reduced": "Yb5Sn3",
"formula_anonymous": "A3B5",
"energy_above_hull": 0.08804625,
"spacegroup": 193
},
{
"id": "jvasp-11051",
"created_at": "2022-09-04T14:38:04.770664Z",
"updated_at": "2022-09-04T14:38:04.770692Z",
"structure_string": "Mo4 O12\n1.0\n0.000000 5.325117 -0.003131\n5.158446 0.000000 0.000000\n0.000000 -0.004581 -7.398674\nMo O\n4 12\ndirect\n0.000000 0.500000 0.000000 Mo\n0.500000 0.000000 -0.000000 Mo\n0.500000 0.000000 0.500000 Mo\n0.000000 0.500000 0.500000 Mo\n0.709346 0.293809 0.546048 O\n0.790654 0.793809 0.453951 O\n0.209333 0.206168 0.953953 O\n0.290667 0.706168 0.046046 O\n0.290654 0.706192 0.453951 O\n0.209346 0.206192 0.546048 O\n0.790667 0.793833 0.046046 O\n0.709334 0.293833 0.953953 O\n0.514476 0.908998 0.749999 O\n0.985525 0.408997 0.250000 O\n0.014476 0.591004 0.749999 O\n0.485524 0.091003 0.250000 O\n",
"nsites": 16,
"nelements": 2,
"elements": [
"Mo",
"O"
],
"chemical_system": "Mo-O",
"density": 4.704170599952906,
"density_atomic": 0.07872594633463532,
"volume": 203.236680471135,
"volume_molar": 7.649499358701988,
"formula_full": "Mo4 O12",
"formula_reduced": "MoO3",
"formula_anonymous": "AB3",
"energy_above_hull": 2.7935991,
"spacegroup": 62
},
{
"id": "jvasp-22961",
"created_at": "2022-09-04T14:38:04.477945Z",
"updated_at": "2022-09-04T14:38:04.477967Z",
"structure_string": "Zr10 Ge6\n1.0\n4.049861 -7.014565 -0.000000\n4.049861 7.014565 -0.000000\n-0.000000 -0.000000 5.629287\nZr Ge\n10 6\ndirect\n0.253342 -0.000000 0.250000 Zr\n0.746658 -0.000000 0.750000 Zr\n0.253342 0.253342 0.750000 Zr\n-0.000000 0.253342 0.250000 Zr\n0.746658 0.746658 0.250000 Zr\n-0.000000 0.746658 0.750000 Zr\n0.333333 0.666667 0.500000 Zr\n0.666667 0.333333 0.000000 Zr\n0.666667 0.333333 0.500000 Zr\n0.333333 0.666667 0.000000 Zr\n-0.000000 0.612965 0.250000 Ge\n0.612965 0.612965 0.750000 Ge\n0.387035 -0.000000 0.750000 Ge\n0.612965 -0.000000 0.250000 Ge\n0.387035 0.387035 0.250000 Ge\n-0.000000 0.387035 0.750000 Ge\n",
"nsites": 16,
"nelements": 2,
"elements": [
"Zr",
"Ge"
],
"chemical_system": "Ge-Zr",
"density": 6.9990728659196755,
"density_atomic": 0.05002599489956777,
"volume": 319.8337190918764,
"volume_molar": 12.038022976034869,
"formula_full": "Zr10 Ge6",
"formula_reduced": "Zr5Ge3",
"formula_anonymous": "A3B5",
"energy_above_hull": 3.39078629375,
"spacegroup": 193
},
{
"id": "jvasp-46238",
"created_at": "2022-09-04T14:38:04.875108Z",
"updated_at": "2022-09-04T14:38:04.875125Z",
"structure_string": "Li4 Al2 Ni2 O8\n1.0\n4.951612 0.000000 0.000000\n0.000000 5.477672 0.000000\n0.000000 0.000000 6.160394\nLi Al Ni O\n4 2 2 8\ndirect\n0.006382 0.665310 0.250507 Li\n0.506382 0.334690 0.249493 Li\n0.006382 0.665310 0.749493 Li\n0.506382 0.334690 0.750506 Li\n0.501926 0.836415 0.000000 Al\n0.001926 0.163585 0.500000 Al\n0.003950 0.170083 0.000000 Ni\n0.503950 0.829917 0.500000 Ni\n0.140167 0.849339 0.000000 O\n0.624914 0.142759 0.000000 O\n0.108155 0.322225 0.260635 O\n0.608155 0.677774 0.239364 O\n0.124915 0.857241 0.500000 O\n0.640167 0.150661 0.500000 O\n0.608155 0.677774 0.760635 O\n0.108155 0.322225 0.739364 O\n",
"nsites": 16,
"nelements": 4,
"elements": [
"Li",
"Al",
"Ni",
"O"
],
"chemical_system": "Al-Li-Ni-O",
"density": 3.250802417014425,
"density_atomic": 0.09575663219155402,
"volume": 167.0902540514707,
"volume_molar": 6.289006434513231,
"formula_full": "Li4 Al2 Ni2 O8",
"formula_reduced": "Li2AlNiO4",
"formula_anonymous": "ABC2D4",
"energy_above_hull": 1.7427224,
"spacegroup": 31
},
{
"id": "jvasp-85278",
"created_at": "2022-09-04T14:38:16.110960Z",
"updated_at": "2022-09-04T14:38:16.110983Z",
"structure_string": "U4 Cu4 As6 O2\n1.0\n3.916148 -0.000000 -0.000000\n0.000000 3.916148 -0.000000\n-0.000000 0.000000 18.068387\nU Cu As O\n4 4 6 2\ndirect\n0.250000 0.250000 0.625541 U\n0.250000 0.250000 0.070363 U\n0.750000 0.750000 0.929637 U\n0.750000 0.750000 0.374459 U\n0.750000 0.250000 0.769622 Cu\n0.250000 0.750000 0.769622 Cu\n0.750000 0.250000 0.230378 Cu\n0.250000 0.750000 0.230378 Cu\n0.750000 0.750000 0.147257 As\n0.750000 0.750000 0.677196 As\n0.250000 0.250000 0.322804 As\n0.250000 0.250000 0.852743 As\n0.250000 0.750000 0.500000 As\n0.750000 0.250000 0.500000 As\n0.250000 0.750000 0.000000 O\n0.750000 0.250000 0.000000 O\n",
"nsites": 16,
"nelements": 4,
"elements": [
"U",
"Cu",
"As",
"O"
],
"chemical_system": "As-Cu-O-U",
"density": 10.11439052880261,
"density_atomic": 0.057740748032231476,
"volume": 277.10067058827565,
"volume_molar": 10.429620268581175,
"formula_full": "U4 Cu4 As6 O2",
"formula_reduced": "U2Cu2As3O",
"formula_anonymous": "AB2C2D3",
"energy_above_hull": 2.84810770625,
"spacegroup": 129
},
{
"id": "jvasp-46191",
"created_at": "2022-09-04T14:38:04.729615Z",
"updated_at": "2022-09-04T14:38:04.729640Z",
"structure_string": "Li4 Fe2 B2 O8\n1.0\n3.469542 3.634607 -0.038444\n-3.469542 3.634607 0.038444\n-0.067435 0.000000 6.068910\nLi Fe B O\n4 2 2 8\ndirect\n0.323305 0.676696 0.716291 Li\n0.176545 0.176545 0.500000 Li\n0.823456 0.823455 0.500000 Li\n0.676696 0.323305 0.283709 Li\n0.195232 0.195232 -0.000000 Fe\n0.804769 0.804769 0.000000 Fe\n0.318141 0.681859 0.256486 B\n0.681860 0.318141 0.743514 B\n0.199108 0.800893 0.029713 O\n0.198697 0.801304 0.437681 O\n0.614977 0.717231 0.245950 O\n0.282770 0.385024 0.245950 O\n0.385025 0.282769 0.754050 O\n0.717232 0.614976 0.754050 O\n0.801305 0.198696 0.562319 O\n0.800894 0.199107 0.970287 O\n",
"nsites": 16,
"nelements": 4,
"elements": [
"Li",
"Fe",
"B",
"O"
],
"chemical_system": "B-Fe-Li-O",
"density": 3.1364408105126076,
"density_atomic": 0.10454497329567376,
"volume": 153.04418276284648,
"volume_molar": 5.76033506935642,
"formula_full": "Li4 Fe2 B2 O8",
"formula_reduced": "Li2FeBO4",
"formula_anonymous": "ABC2D4",
"energy_above_hull": 2.5007377604166665,
"spacegroup": 12
},
{
"id": "jvasp-46441",
"created_at": "2022-09-04T14:38:28.883846Z",
"updated_at": "2022-09-04T14:38:28.883880Z",
"structure_string": "Li4 Cr1 Fe3 O8\n1.0\n1.436126 0.829144 4.754447\n5.742559 0.000515 0.000480\n-2.870832 4.972416 -0.000001\nLi Cr Fe O\n4 1 3 8\ndirect\n0.001535 0.998768 0.499383 Li\n0.998465 0.001232 0.000615 Li\n0.000000 0.500000 0.498846 Li\n0.000000 0.500000 0.001153 Li\n0.500000 0.500000 0.249999 Cr\n0.500000 0.000001 0.750000 Fe\n0.500000 0.000000 0.250000 Fe\n0.500000 0.500000 0.750000 Fe\n0.274904 0.241671 0.620834 O\n0.726191 0.257525 0.878042 O\n0.274598 0.240912 0.120456 O\n0.726192 0.257524 0.379483 O\n0.273809 0.742476 0.621958 O\n0.725097 0.758329 0.879164 O\n0.273809 0.742476 0.120515 O\n0.725403 0.759088 0.379543 O\n",
"nsites": 16,
"nelements": 4,
"elements": [
"Li",
"Cr",
"Fe",
"O"
],
"chemical_system": "Cr-Fe-Li-O",
"density": 4.590242435426121,
"density_atomic": 0.11785260030739582,
"volume": 135.76280844264005,
"volume_molar": 5.109892140090592,
"formula_full": "Li4 Cr1 Fe3 O8",
"formula_reduced": "Li4CrFe3O8",
"formula_anonymous": "AB3C4D8",
"energy_above_hull": 2.77963074375,
"spacegroup": 12
},
{
"id": "jvasp-9079",
"created_at": "2022-09-04T14:38:12.765302Z",
"updated_at": "2022-09-04T14:38:12.765328Z",
"structure_string": "Ti6 O10\n1.0\n3.861050 0.000000 0.000000\n-1.930525 4.891258 -0.113411\n0.000000 0.032681 9.333716\nTi O\n6 10\ndirect\n0.943485 0.886968 0.640003 Ti\n0.056517 0.113033 0.359997 Ti\n0.868554 0.737105 0.955241 Ti\n0.131448 0.262895 0.044759 Ti\n0.220782 0.441562 0.737056 Ti\n0.779219 0.558438 0.262945 Ti\n0.587478 0.174956 0.340543 O\n0.412523 0.825044 0.659458 O\n0.673385 0.346770 0.054660 O\n0.326616 0.653230 0.945340 O\n0.871344 0.742684 0.442586 O\n0.128658 0.257316 0.557415 O\n0.242476 0.484952 0.243561 O\n0.757526 0.515049 0.756439 O\n0.042575 0.085150 0.847086 O\n0.957427 0.914850 0.152915 O\n",
"nsites": 16,
"nelements": 2,
"elements": [
"Ti",
"O"
],
"chemical_system": "O-Ti",
"density": 4.212415205460059,
"density_atomic": 0.09076201867856189,
"volume": 176.28519322234095,
"volume_molar": 6.635089046804595,
"formula_full": "Ti6 O10",
"formula_reduced": "Ti3O5",
"formula_anonymous": "A3B5",
"energy_above_hull": 3.0293428125,
"spacegroup": 12
},
{
"id": "jvasp-46888",
"created_at": "2022-09-04T14:38:04.677711Z",
"updated_at": "2022-09-04T14:38:04.677736Z",
"structure_string": "Li4 Cr3 Fe1 O8\n1.0\n5.801716 -0.001383 -0.003790\n-2.899656 5.025069 -0.000023\n-2.897904 -1.672569 4.756129\nLi Cr Fe O\n4 3 1 8\ndirect\n0.500001 0.500000 0.500001 Li\n0.500001 0.000000 0.500000 Li\n0.000000 -0.000000 0.500000 Li\n0.000000 0.500000 0.500000 Li\n0.500000 0.500000 0.000000 Cr\n0.500001 0.000000 0.000000 Cr\n-0.000000 0.500000 0.000000 Cr\n0.000000 0.000000 0.000000 Fe\n0.514929 0.257460 0.772379 O\n0.985532 0.744762 0.226320 O\n0.518455 0.759223 0.773684 O\n0.014471 0.759220 0.773681 O\n0.985531 0.240781 0.226320 O\n0.481546 0.240778 0.226317 O\n0.014470 0.255239 0.773681 O\n0.485073 0.742541 0.227623 O\n",
"nsites": 16,
"nelements": 4,
"elements": [
"Li",
"Cr",
"Fe",
"O"
],
"chemical_system": "Cr-Fe-Li-O",
"density": 4.405087970740028,
"density_atomic": 0.11546725171660137,
"volume": 138.56742723269988,
"volume_molar": 5.215453447164849,
"formula_full": "Li4 Cr3 Fe1 O8",
"formula_reduced": "Li4Cr3FeO8",
"formula_anonymous": "AB3C4D8",
"energy_above_hull": 2.97729348125,
"spacegroup": 166
},
{
"id": "jvasp-119270",
"created_at": "2022-09-04T14:38:28.992180Z",
"updated_at": "2022-09-04T14:38:28.992201Z",
"structure_string": "V4 O1 F11\n1.0\n5.005103 -0.005829 0.003849\n0.008593 7.222434 -0.545052\n-0.004270 -0.115755 5.355803\nV O F\n4 1 11\ndirect\n0.509144 0.487603 0.500071 V\n0.509143 0.012391 0.499936 V\n0.001547 0.500784 0.999872 V\n0.001533 -0.000779 0.000133 V\n0.593972 0.250004 0.500018 O\n0.868965 0.250005 0.000022 F\n0.818394 0.563269 0.315688 F\n0.818367 0.936728 0.684331 F\n0.686604 0.933288 0.183637 F\n0.686604 0.566719 0.816368 F\n0.385332 0.749993 0.499989 F\n0.314997 0.436730 0.182431 F\n0.314952 0.063274 0.817537 F\n0.179604 0.058514 0.316937 F\n0.179564 0.441472 0.683037 F\n0.131271 0.750005 -0.000007 F\n",
"nsites": 16,
"nelements": 3,
"elements": [
"V",
"O",
"F"
],
"chemical_system": "F-O-V",
"density": 3.6833072685157218,
"density_atomic": 0.0827764686649481,
"volume": 193.29164747004046,
"volume_molar": 7.275184429980509,
"formula_full": "V4 O1 F11",
"formula_reduced": "V4OF11",
"formula_anonymous": "AB4C11",
"energy_above_hull": 1.23385271296875,
"spacegroup": 3
},
{
"id": "jvasp-12554",
"created_at": "2022-09-04T14:38:12.381258Z",
"updated_at": "2022-09-04T14:38:12.381281Z",
"structure_string": "Li4 H8 N4\n1.0\n4.519140 0.000000 -1.991410\n-0.877537 4.433120 -1.991410\n0.038559 0.046940 6.210887\nLi H N\n4 8 4\ndirect\n0.250000 0.750000 0.500000 Li\n0.007721 0.507722 0.015443 Li\n0.492278 0.992278 0.984557 Li\n0.000000 0.000000 0.000000 Li\n0.704331 0.792634 0.249859 H\n0.542774 0.295668 0.750142 H\n0.207366 0.454473 0.750142 H\n0.545527 0.457226 0.249859 H\n0.963166 0.084099 0.384169 H\n0.421004 0.300070 0.384169 H\n0.915901 0.578996 0.615831 H\n0.699930 0.036834 0.615832 H\n0.348698 0.361342 0.232782 N\n0.128559 0.651302 0.767219 N\n0.638658 0.115915 0.767219 N\n0.884084 0.871441 0.232782 N\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Li",
"H",
"N"
],
"chemical_system": "H-Li-N",
"density": 1.2175614103850216,
"density_atomic": 0.12772095988198043,
"volume": 125.27309546361596,
"volume_molar": 4.71507633951758,
"formula_full": "Li4 H8 N4",
"formula_reduced": "LiH2N",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.6073308125,
"spacegroup": 82
}
]
}