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=1206",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=formula_anonymous&page=1204",
"results": [
{
"id": "jvasp-86907",
"created_at": "2022-09-04T14:36:06.821864Z",
"updated_at": "2022-09-04T14:36:06.821890Z",
"structure_string": "Y3 Co9 H6\n1.0\n5.040762 0.204657 8.133124\n2.470239 4.398759 8.133124\n0.333921 0.204656 9.562713\nY Co H\n3 9 6\ndirect\n0.127714 0.127715 0.127714 Y\n0.000000 0.000000 0.000000 Y\n0.872285 0.872288 0.872284 Y\n0.332233 0.332234 0.332232 Co\n0.499999 0.500001 0.499999 Co\n0.570593 0.072429 0.570593 Co\n0.667766 0.667768 0.667766 Co\n0.927571 0.429409 0.429406 Co\n0.429407 0.927573 0.429406 Co\n0.429407 0.429409 0.927571 Co\n0.072427 0.570594 0.570593 Co\n0.570593 0.570594 0.072427 Co\n0.368315 0.860717 0.368314 H\n0.139284 0.631686 0.631684 H\n0.631685 0.631686 0.139283 H\n0.631684 0.139285 0.631684 H\n0.860715 0.368316 0.368314 H\n0.368314 0.368316 0.860715 H\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Y",
"Co",
"H"
],
"chemical_system": "Co-H-Y",
"density": 6.963268692989238,
"density_atomic": 0.09397933272524193,
"volume": 191.53147269756445,
"volume_molar": 6.4079416030823895,
"formula_full": "Y3 Co9 H6",
"formula_reduced": "YCo3H2",
"formula_anonymous": "AB2C3",
"energy_above_hull": 3.269704691666667,
"spacegroup": 166
},
{
"id": "jvasp-42222",
"created_at": "2022-09-04T14:35:55.723131Z",
"updated_at": "2022-09-04T14:35:55.723155Z",
"structure_string": "Na8 Bi4 O12\n1.0\n5.924567 0.007546 -0.000115\n-2.045809 5.560188 -0.003154\n-1.939370 -2.778317 10.261751\nNa Bi O\n8 4 12\ndirect\n0.504121 0.004543 0.005709 Na\n0.579872 0.580227 0.157214 Na\n0.670198 0.170669 0.337949 Na\n0.748360 0.748791 0.494206 Na\n0.254131 0.254575 0.505710 Na\n0.830042 0.330257 0.657217 Na\n0.420326 0.420716 0.837948 Na\n0.998398 0.498795 0.994202 Na\n0.334514 0.834955 0.666394 Bi\n0.917110 0.917489 0.831630 Bi\n0.084415 0.084864 0.166395 Bi\n0.167073 0.667509 0.331633 Bi\n0.785366 0.780437 0.012297 O\n0.308332 0.861176 0.169956 O\n0.864102 0.312164 0.169971 O\n0.929638 0.923606 0.314848 O\n0.387654 0.394600 0.314839 O\n0.484799 0.979905 0.512288 O\n0.030066 0.535892 0.512304 O\n0.561754 0.614593 0.669925 O\n0.110814 0.058869 0.670000 O\n0.644277 0.138177 0.814845 O\n0.173285 0.680162 0.814847 O\n0.229389 0.235170 0.012295 O\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Na",
"Bi",
"O"
],
"chemical_system": "Bi-Na-O",
"density": 5.950996787580724,
"density_atomic": 0.07097562818383794,
"volume": 338.14424210288433,
"volume_molar": 8.484800929696199,
"formula_full": "Na8 Bi4 O12",
"formula_reduced": "Na2BiO3",
"formula_anonymous": "AB2C3",
"energy_above_hull": 0.9834904666666666,
"spacegroup": 43
},
{
"id": "jvasp-52797",
"created_at": "2022-09-04T14:36:03.734929Z",
"updated_at": "2022-09-04T14:36:03.734958Z",
"structure_string": "Li4 Mo2 O6\n1.0\n4.968185 -0.052724 -0.090047\n0.773105 5.172585 -0.041956\n2.369631 1.295441 4.167810\nLi Mo O\n4 2 6\ndirect\n0.972886 0.986750 0.026309 Li\n0.360384 0.013251 0.307055 Li\n0.666673 0.000005 0.666655 Li\n0.666675 0.500001 0.166664 Li\n0.025656 0.497823 0.523401 Mo\n0.307695 0.502176 0.809928 Mo\n0.312088 0.728054 0.101603 O\n0.021260 0.271949 0.231728 O\n0.660625 0.726045 0.441402 O\n0.343611 0.233591 0.579139 O\n-0.010263 0.766410 0.754181 O\n0.672723 0.273954 0.891925 O\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Li",
"Mo",
"O"
],
"chemical_system": "Li-Mo-O",
"density": 4.827847877594626,
"density_atomic": 0.1105333011748411,
"volume": 108.56456717074298,
"volume_molar": 5.4482592087557435,
"formula_full": "Li4 Mo2 O6",
"formula_reduced": "Li2MoO3",
"formula_anonymous": "AB2C3",
"energy_above_hull": 2.3298110666666663,
"spacegroup": 2
},
{
"id": "jvasp-115585",
"created_at": "2022-09-04T14:38:47.118370Z",
"updated_at": "2022-09-04T14:38:47.118386Z",
"structure_string": "Ba2 Zr1 O3\n1.0\n-1.970250 2.127508 6.918195\n1.970250 -2.127508 6.918195\n1.970250 2.127508 -6.918195\nBa Zr O\n2 1 3\ndirect\n0.649347 0.649347 0.000000 Ba\n0.350654 0.350654 0.000000 Ba\n0.000000 0.000000 0.000000 Zr\n0.848353 0.848353 0.000000 O\n0.151647 0.151647 0.000000 O\n0.500001 0.000000 0.500001 O\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Zr",
"O"
],
"chemical_system": "Ba-O-Zr",
"density": 5.924807193381293,
"density_atomic": 0.0517256458429834,
"volume": 115.99661835472088,
"volume_molar": 11.642466056935481,
"formula_full": "Ba2 Zr1 O3",
"formula_reduced": "Ba2ZrO3",
"formula_anonymous": "AB2C3",
"energy_above_hull": 1.565007823333333,
"spacegroup": 71
},
{
"id": "jvasp-105553",
"created_at": "2022-09-04T14:38:48.482754Z",
"updated_at": "2022-09-04T14:38:48.482781Z",
"structure_string": "Ba2 Al1 Ga3\n1.0\n4.786867 -0.004033 3.921856\n2.243350 4.228652 3.921856\n-0.011442 -0.006876 7.917017\nBa Al Ga\n2 1 3\ndirect\n0.251605 0.251604 0.189088 Ba\n0.748244 0.748242 0.810566 Ba\n0.424065 0.424065 0.416550 Al\n0.573351 0.573350 0.584095 Ga\n0.925700 0.925700 0.236988 Ga\n0.077039 0.077037 0.762715 Ga\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Al",
"Ga"
],
"chemical_system": "Al-Ba-Ga",
"density": 5.281960608221452,
"density_atomic": 0.03736307085640747,
"volume": 160.58637211751153,
"volume_molar": 16.11789561715656,
"formula_full": "Ba2 Al1 Ga3",
"formula_reduced": "Ba2AlGa3",
"formula_anonymous": "AB2C3",
"energy_above_hull": 0.0,
"spacegroup": 8
},
{
"id": "jvasp-111849",
"created_at": "2022-09-04T14:38:42.340413Z",
"updated_at": "2022-09-04T14:38:42.340440Z",
"structure_string": "Al2 In4 N6\n1.0\n5.927412 -0.000449 -0.000000\n-2.950058 5.125835 0.000000\n0.000000 -0.000000 5.499476\nAl In N\n2 4 6\ndirect\n-0.000001 0.658745 0.489382 Al\n-0.000000 0.341254 0.989383 Al\n0.323843 0.335328 0.487493 In\n0.676156 0.011484 0.487493 In\n0.676155 0.664671 0.987493 In\n0.323843 0.988515 0.987493 In\n0.302002 0.332976 0.885230 N\n0.697997 0.030974 0.885230 N\n0.697997 0.667023 0.385230 N\n0.302001 0.969025 0.385230 N\n-0.000001 0.631595 0.837176 N\n-0.000000 0.368404 0.337175 N\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Al",
"In",
"N"
],
"chemical_system": "Al-In-N",
"density": 5.935967597333171,
"density_atomic": 0.07182061698158533,
"volume": 167.08294225705103,
"volume_molar": 8.384974973890944,
"formula_full": "Al2 In4 N6",
"formula_reduced": "AlIn2N3",
"formula_anonymous": "AB2C3",
"energy_above_hull": 2.900788748333333,
"spacegroup": 36
},
{
"id": "jvasp-116835",
"created_at": "2022-09-04T14:38:43.501061Z",
"updated_at": "2022-09-04T14:38:43.501088Z",
"structure_string": "Na8 Co4 O12\n1.0\n5.790832 -0.076291 0.000000\n-3.258964 4.787349 0.000000\n-0.000000 -0.000000 11.243815\nNa Co O\n8 4 12\ndirect\n0.956907 0.043093 0.145954 Na\n0.632998 0.367003 0.074036 Na\n0.867002 0.132998 0.574036 Na\n0.543093 0.456908 0.645953 Na\n0.456908 0.543093 0.354046 Na\n0.132998 0.867003 0.425963 Na\n0.043093 0.956908 0.854046 Na\n0.367003 0.632998 0.925963 Na\n0.252455 0.747545 0.157121 Co\n0.247546 0.752455 0.657121 Co\n0.752455 0.247545 0.342879 Co\n0.747545 0.252455 0.842878 Co\n0.342458 0.657542 0.530447 O\n0.450946 0.049054 0.250000 O\n0.657542 0.342458 0.469552 O\n0.921811 0.078189 0.357066 O\n0.842458 0.157542 0.969552 O\n0.578189 0.421812 0.857066 O\n0.950946 0.549055 0.250000 O\n0.049055 0.450946 0.750000 O\n0.157543 0.842458 0.030447 O\n0.078189 0.921812 0.642934 O\n0.421812 0.578189 0.142934 O\n0.549055 0.950946 0.750000 O\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Na",
"Co",
"O"
],
"chemical_system": "Co-Na-O",
"density": 3.287837895445279,
"density_atomic": 0.07769159005823559,
"volume": 308.91374448650396,
"volume_molar": 7.751341883318336,
"formula_full": "Na8 Co4 O12",
"formula_reduced": "Na2CoO3",
"formula_anonymous": "AB2C3",
"energy_above_hull": 1.4558982333333332,
"spacegroup": 64
},
{
"id": "jvasp-110155",
"created_at": "2022-09-04T14:38:36.951019Z",
"updated_at": "2022-09-04T14:38:36.951039Z",
"structure_string": "Tb1 Co2 Ni3\n1.0\n3.964836 0.000000 0.000000\n-0.000000 4.304811 2.372583\n-0.000000 0.001169 4.746082\nTb Co Ni\n1 2 3\ndirect\n0.000000 0.999981 0.000018 Tb\n0.500001 0.499984 0.500010 Co\n0.500001 0.499983 0.000021 Co\n0.500001 -0.000016 0.500015 Ni\n0.000000 0.340334 0.329774 Ni\n0.000000 0.659634 0.670259 Ni\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Tb",
"Co",
"Ni"
],
"chemical_system": "Co-Ni-Tb",
"density": 9.284722244208865,
"density_atomic": 0.07407909303206316,
"volume": 80.99451214127393,
"volume_molar": 8.129339215038009,
"formula_full": "Tb1 Co2 Ni3",
"formula_reduced": "TbCo2Ni3",
"formula_anonymous": "AB2C3",
"energy_above_hull": 2.0072579,
"spacegroup": 65
},
{
"id": "jvasp-119277",
"created_at": "2022-09-04T14:38:48.685386Z",
"updated_at": "2022-09-04T14:38:48.685402Z",
"structure_string": "Li8 Fe4 O12\n1.0\n4.896672 -0.069112 0.865263\n-2.404183 8.129993 0.171452\n-0.039525 -0.121182 4.892809\nLi Fe O\n8 4 12\ndirect\n0.000001 0.500001 0.000003 Li\n0.999999 -0.000001 0.499997 Li\n0.500001 0.750001 0.750000 Li\n0.500000 0.249999 0.250000 Li\n0.000069 0.169504 0.008435 Li\n0.000075 0.669505 0.508437 Li\n-0.000071 0.830497 0.991562 Li\n-0.000070 0.330494 0.491564 Li\n0.500010 0.583416 0.250276 Fe\n0.499991 0.916583 0.249722 Fe\n0.500010 0.083419 0.750276 Fe\n0.499992 0.416582 0.749724 Fe\n0.723566 0.466611 0.390884 O\n0.727894 0.609791 0.890354 O\n0.727892 0.109790 0.390354 O\n0.272109 0.390210 0.109645 O\n0.272107 0.890209 0.609645 O\n0.723617 0.287952 0.854780 O\n0.723618 0.787952 0.354781 O\n0.276436 0.533390 0.609116 O\n0.276434 0.033389 0.109116 O\n0.276383 0.712048 0.145218 O\n0.276384 0.212049 0.645219 O\n0.723566 0.966610 0.890883 O\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Li",
"Fe",
"O"
],
"chemical_system": "Fe-Li-O",
"density": 4.01820445790464,
"density_atomic": 0.12332886853277099,
"volume": 194.6016393852078,
"volume_molar": 4.8829936021020055,
"formula_full": "Li8 Fe4 O12",
"formula_reduced": "Li2FeO3",
"formula_anonymous": "AB2C3",
"energy_above_hull": 1.902226,
"spacegroup": 12
},
{
"id": "jvasp-112684",
"created_at": "2022-09-04T14:38:42.349062Z",
"updated_at": "2022-09-04T14:38:42.349088Z",
"structure_string": "Dy6 Ni2 Pd4\n1.0\n4.438978 -0.000000 0.000000\n0.000000 5.462452 0.677932\n0.000000 0.016985 10.511723\nDy Ni Pd\n6 2 4\ndirect\n0.250000 0.401205 0.782714 Dy\n0.750000 0.598795 0.217286 Dy\n0.250000 0.114020 0.124589 Dy\n0.750000 0.885981 0.875411 Dy\n0.250000 0.262250 0.457052 Dy\n0.750000 0.737751 0.542948 Dy\n0.250000 0.772480 0.361836 Ni\n0.750000 0.227521 0.638163 Ni\n0.250000 0.649194 0.029715 Pd\n0.750000 0.350807 0.970285 Pd\n0.250000 0.919329 0.691032 Pd\n0.750000 0.080671 0.308968 Pd\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Dy",
"Ni",
"Pd"
],
"chemical_system": "Dy-Ni-Pd",
"density": 9.891964415908266,
"density_atomic": 0.047089470997795736,
"volume": 254.8340371154673,
"volume_molar": 12.78872034957007,
"formula_full": "Dy6 Ni2 Pd4",
"formula_reduced": "Dy3NiPd2",
"formula_anonymous": "AB2C3",
"energy_above_hull": 1.4522422166666666,
"spacegroup": 11
},
{
"id": "jvasp-111024",
"created_at": "2022-09-04T14:38:36.839658Z",
"updated_at": "2022-09-04T14:38:36.839669Z",
"structure_string": "Na2 Tb1 O3\n1.0\n4.264536 -0.010951 -4.109635\n-0.433331 3.231265 -4.944354\n0.019464 0.010951 5.922414\nTb Na O\n1 2 3\ndirect\n0.000000 0.000000 0.000000 Tb\n0.677036 0.677034 0.000001 Na\n0.322965 0.322965 0.000000 Na\n0.500000 -0.000000 0.500000 O\n0.147338 0.647338 0.499999 O\n0.852662 0.352661 0.500000 O\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Tb",
"Na",
"O"
],
"chemical_system": "Na-O-Tb",
"density": 5.115682302912124,
"density_atomic": 0.07308892690311745,
"volume": 82.09177852553863,
"volume_molar": 8.239470758658982,
"formula_full": "Na2 Tb1 O3",
"formula_reduced": "Na2TbO3",
"formula_anonymous": "AB2C3",
"energy_above_hull": 0.9510628166666668,
"spacegroup": 71
},
{
"id": "jvasp-108785",
"created_at": "2022-09-04T14:38:46.194351Z",
"updated_at": "2022-09-04T14:38:46.194366Z",
"structure_string": "Dy2 Ga1 Cu3\n1.0\n4.259424 0.011873 3.273129\n2.093970 3.709194 3.273129\n-0.026876 -0.015741 6.868674\nDy Ga Cu\n2 1 3\ndirect\n0.457480 0.457480 0.795325 Dy\n0.543163 0.543162 0.205991 Dy\n0.831760 0.831759 0.612350 Ga\n0.164544 0.164544 0.384629 Cu\n0.164715 0.164716 0.790004 Cu\n0.838338 0.838337 0.211703 Cu\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Dy",
"Ga",
"Cu"
],
"chemical_system": "Cu-Dy-Ga",
"density": 8.935237780568551,
"density_atomic": 0.055154948475128134,
"volume": 108.78443668034015,
"volume_molar": 10.918586503105256,
"formula_full": "Dy2 Ga1 Cu3",
"formula_reduced": "Dy2GaCu3",
"formula_anonymous": "AB2C3",
"energy_above_hull": 0.2273459041666666,
"spacegroup": 8
}
]
}