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=-density&page=4322",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-density&page=4320",
"results": [
{
"id": "jvasp-1645",
"created_at": "2022-09-04T14:37:00.480283Z",
"updated_at": "2022-09-04T14:37:00.480304Z",
"structure_string": "Mg1 C1 N2\n1.0\n3.107277 0.009008 4.053820\n1.381328 2.783376 4.053820\n0.014480 0.009008 5.107683\nMg C N\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Mg\n0.500000 0.500002 0.499998 C\n0.413618 0.413619 0.413617 N\n0.586382 0.586384 0.586380 N\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Mg",
"C",
"N"
],
"chemical_system": "C-Mg-N",
"density": 2.4340845156313313,
"density_atomic": 0.09114630597930908,
"volume": 43.885486713065816,
"volume_molar": 6.607114457679802,
"formula_full": "Mg1 C1 N2",
"formula_reduced": "MgCN2",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.6749613875,
"spacegroup": 166
},
{
"id": "jvasp-8608",
"created_at": "2022-09-04T14:36:44.248933Z",
"updated_at": "2022-09-04T14:36:44.248954Z",
"structure_string": "Rb2 Ca1 H4\n1.0\n4.287704 -0.000000 -1.244240\n-0.361063 4.272475 -1.244240\n-0.000384 -0.000418 8.008603\nRb Ca H\n2 1 4\ndirect\n0.648133 0.648132 0.296264 Rb\n0.351868 0.351867 0.703735 Rb\n0.000000 0.000000 0.000000 Ca\n0.500000 0.000000 -0.000000 H\n0.000000 0.499999 -0.000000 H\n0.843277 0.843276 0.686554 H\n0.156723 0.156723 0.313446 H\n",
"nsites": 7,
"nelements": 3,
"elements": [
"Rb",
"Ca",
"H"
],
"chemical_system": "Ca-H-Rb",
"density": 2.4340600137124455,
"density_atomic": 0.047714474835219046,
"volume": 146.706005340609,
"volume_molar": 12.621203064263703,
"formula_full": "Rb2 Ca1 H4",
"formula_reduced": "Rb2CaH4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 1.236838631428571,
"spacegroup": 139
},
{
"id": "jvasp-20781",
"created_at": "2022-09-04T14:38:34.575778Z",
"updated_at": "2022-09-04T14:38:34.575803Z",
"structure_string": "Sr4 Mg8\n1.0\n3.218751 -5.575041 -0.000000\n3.218751 5.575041 0.000000\n-0.000000 0.000000 10.358802\nSr Mg\n4 8\ndirect\n0.333333 0.666667 0.939591 Sr\n0.333333 0.666667 0.560409 Sr\n0.666667 0.333333 0.060409 Sr\n0.666667 0.333333 0.439591 Sr\n0.832960 0.167040 0.750000 Mg\n0.665920 0.832960 0.250000 Mg\n0.334080 0.167040 0.750000 Mg\n0.832960 0.665920 0.750000 Mg\n0.167040 0.334080 0.250000 Mg\n0.167040 0.832960 0.250000 Mg\n0.000000 0.000000 0.500000 Mg\n0.000000 0.000000 0.000000 Mg\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Sr",
"Mg"
],
"chemical_system": "Mg-Sr",
"density": 2.4339232026030513,
"density_atomic": 0.03227797430119107,
"volume": 371.77054198091963,
"volume_molar": 18.65712111858823,
"formula_full": "Sr4 Mg8",
"formula_reduced": "SrMg2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.1507203921568627,
"spacegroup": 194
},
{
"id": "jvasp-34455",
"created_at": "2022-09-04T14:37:11.669234Z",
"updated_at": "2022-09-04T14:37:11.669260Z",
"structure_string": "Li8 C2 O8\n1.0\n4.835221 0.000000 0.000000\n0.000000 5.063579 0.000000\n0.000000 0.000000 5.784036\nLi C O\n8 2 8\ndirect\n0.593426 0.421408 0.298451 Li\n0.093426 0.578592 0.798451 Li\n0.593426 0.421408 0.701550 Li\n0.968727 0.090373 0.000000 Li\n0.955410 0.910583 0.500000 Li\n0.455410 0.089417 0.000000 Li\n0.468727 0.909627 0.500000 Li\n0.093426 0.578592 0.201549 Li\n0.160358 0.307280 0.500000 C\n0.660358 0.692720 0.000000 C\n0.764963 0.821545 0.800056 O\n0.375711 0.693654 0.000000 O\n0.264963 0.178455 0.300056 O\n0.265736 0.575774 0.500000 O\n0.764963 0.821545 0.199944 O\n0.765736 0.424226 0.000000 O\n0.264963 0.178455 0.699945 O\n0.875711 0.306346 0.500000 O\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Li",
"C",
"O"
],
"chemical_system": "C-Li-O",
"density": 2.433636046051747,
"density_atomic": 0.12710645277880847,
"volume": 141.61358142315342,
"volume_molar": 4.737871782544172,
"formula_full": "Li8 C2 O8",
"formula_reduced": "Li4CO4",
"formula_anonymous": "AB4C4",
"energy_above_hull": 2.2161293333333334,
"spacegroup": 31
},
{
"id": "jvasp-100674",
"created_at": "2022-09-04T14:36:35.616743Z",
"updated_at": "2022-09-04T14:36:35.616770Z",
"structure_string": "K2 Na1 Sb1 Cl6\n1.0\n6.488099 -0.000000 3.745906\n2.162700 6.117039 3.745906\n-0.000000 -0.000000 7.491812\nK Na Sb Cl\n2 1 1 6\ndirect\n0.750000 0.750000 0.750001 K\n0.250000 0.250000 0.250000 K\n0.500000 0.500000 0.500000 Na\n0.000000 0.000000 0.000000 Sb\n0.751021 0.248979 0.248980 Cl\n0.248979 0.248979 0.751021 Cl\n0.248979 0.751021 0.751021 Cl\n0.248979 0.751021 0.248980 Cl\n0.751021 0.248979 0.751021 Cl\n0.751021 0.751021 0.248980 Cl\n",
"nsites": 10,
"nelements": 4,
"elements": [
"K",
"Na",
"Sb",
"Cl"
],
"chemical_system": "Cl-K-Na-Sb",
"density": 2.4330753123860758,
"density_atomic": 0.03363213301135593,
"volume": 297.3346946690383,
"volume_molar": 17.905913841285702,
"formula_full": "K2 Na1 Sb1 Cl6",
"formula_reduced": "K2NaSbCl6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-12982",
"created_at": "2022-09-04T14:36:47.075811Z",
"updated_at": "2022-09-04T14:36:47.075838Z",
"structure_string": "P3 Br1 Cl14\n1.0\n7.490122 -0.009088 -4.313719\n-4.985081 7.061083 -0.016062\n-0.006416 0.009089 8.643498\nP Br Cl\n3 1 14\ndirect\n0.499999 0.248079 0.748079 P\n-0.000000 0.498087 0.498087 P\n0.500000 0.748079 0.248080 P\n0.000000 -0.002030 -0.002030 Br\n0.730915 0.520803 0.892466 Cl\n0.371663 0.892466 0.161550 Cl\n0.628336 0.789886 0.520803 Cl\n0.269084 0.161550 0.789886 Cl\n-0.000000 0.674915 0.674916 Cl\n0.269080 0.475357 0.103663 Cl\n0.730920 0.834582 0.206277 Cl\n0.628305 0.103663 0.834582 Cl\n0.663018 0.388249 0.270932 Cl\n0.882682 0.270932 0.607915 Cl\n0.117317 0.725231 0.388250 Cl\n0.336981 0.607915 0.725231 Cl\n-0.000000 0.321255 0.321256 Cl\n0.371694 0.206277 0.475357 Cl\n",
"nsites": 18,
"nelements": 3,
"elements": [
"P",
"Br",
"Cl"
],
"chemical_system": "Br-Cl-P",
"density": 2.432793077805575,
"density_atomic": 0.03940886053298658,
"volume": 456.75007489580616,
"volume_molar": 15.281184684239372,
"formula_full": "P3 Br1 Cl14",
"formula_reduced": "P3BrCl14",
"formula_anonymous": "AB3C14",
"energy_above_hull": 0.6843826416666667,
"spacegroup": 87
},
{
"id": "jvasp-106794",
"created_at": "2022-09-04T14:36:55.262111Z",
"updated_at": "2022-09-04T14:36:55.262135Z",
"structure_string": "K1 Nb1 Cl6\n1.0\n5.951926 -0.067065 3.553087\n1.984566 5.611722 3.553087\n-0.095996 -0.067065 6.931136\nK Nb Cl\n1 1 6\ndirect\n0.743192 0.743190 0.743193 K\n0.992982 0.992979 0.992982 Nb\n0.236498 0.749648 0.749650 Cl\n0.749650 0.749648 0.236499 Cl\n0.749649 0.236497 0.749650 Cl\n0.749554 0.236351 0.236353 Cl\n0.236352 0.236351 0.749555 Cl\n0.236353 0.749553 0.236353 Cl\n",
"nsites": 8,
"nelements": 3,
"elements": [
"K",
"Nb",
"Cl"
],
"chemical_system": "Cl-K-Nb",
"density": 2.4326586724889507,
"density_atomic": 0.03399790916414519,
"volume": 235.30858798919743,
"volume_molar": 17.713267986347404,
"formula_full": "K1 Nb1 Cl6",
"formula_reduced": "KNbCl6",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.564607725625,
"spacegroup": 216
},
{
"id": "jvasp-36388",
"created_at": "2022-09-04T14:37:28.435486Z",
"updated_at": "2022-09-04T14:37:28.435504Z",
"structure_string": "Sc1 P1\n1.0\n2.959417 2.959417 0.000000\n2.959417 0.000000 -2.959417\n0.000000 2.959417 -2.959417\nSc P\n1 1\ndirect\n0.000000 0.000000 0.000000 Sc\n0.750001 0.750001 0.750001 P\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Sc",
"P"
],
"chemical_system": "P-Sc",
"density": 2.4322720228828203,
"density_atomic": 0.03858171310855922,
"volume": 51.83802995923234,
"volume_molar": 15.60879565677971,
"formula_full": "Sc1 P1",
"formula_reduced": "ScP",
"formula_anonymous": "AB",
"energy_above_hull": 1.3281853750000003,
"spacegroup": 216
},
{
"id": "jvasp-107716",
"created_at": "2022-09-04T14:37:02.034563Z",
"updated_at": "2022-09-04T14:37:02.034584Z",
"structure_string": "K2 Na1 Cr1 Cl6\n1.0\n6.122566 -0.000000 3.534865\n2.040855 5.772411 3.534865\n-0.000000 -0.000000 7.069730\nK Na Cr Cl\n2 1 1 6\ndirect\n0.250000 0.250000 0.250000 K\n0.750001 0.750000 0.750000 K\n0.500001 0.500000 0.500000 Na\n0.000000 0.000000 0.000000 Cr\n0.765480 0.234521 0.234521 Cl\n0.234521 0.765479 0.765480 Cl\n0.234521 0.765479 0.234521 Cl\n0.765480 0.234521 0.765480 Cl\n0.234521 0.234521 0.765480 Cl\n0.765480 0.765479 0.234521 Cl\n",
"nsites": 10,
"nelements": 4,
"elements": [
"K",
"Na",
"Cr",
"Cl"
],
"chemical_system": "Cl-Cr-K-Na",
"density": 2.431747706425338,
"density_atomic": 0.040022706215101754,
"volume": 249.8581666680676,
"volume_molar": 15.046810497106435,
"formula_full": "K2 Na1 Cr1 Cl6",
"formula_reduced": "K2NaCrCl6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.1677426805000005,
"spacegroup": 225
},
{
"id": "jvasp-101780",
"created_at": "2022-09-04T14:36:56.666911Z",
"updated_at": "2022-09-04T14:36:56.666935Z",
"structure_string": "Li8 B16 O28\n1.0\n8.447627 -0.140883 0.000000\n-2.020229 8.203714 0.000000\n-3.213699 -4.031416 6.693435\nLi B O\n8 16 28\ndirect\n0.001672 0.986739 0.683750 Li\n0.067923 0.251672 0.514933 Li\n0.736740 0.552990 0.485068 Li\n0.302991 0.317923 0.316251 Li\n0.501672 0.817923 0.014933 Li\n0.802991 0.486740 0.985068 Li\n0.236740 0.751672 0.183749 Li\n0.567923 0.052991 0.816251 Li\n0.555498 0.112086 0.332030 B\n0.780056 0.223468 0.667970 B\n0.862086 0.030056 0.056588 B\n0.973468 0.805498 0.943413 B\n0.362086 0.305498 0.832031 B\n0.055498 0.723468 0.443413 B\n0.473468 0.530056 0.167970 B\n0.280056 0.612086 0.556588 B\n0.130342 0.387680 0.921420 B\n0.958923 0.380342 0.242662 B\n0.137681 0.716261 0.757339 B\n0.458923 0.216261 0.578581 B\n0.630342 0.708923 0.742662 B\n0.966262 0.887680 0.257339 B\n0.637681 0.880342 0.421419 B\n0.466262 0.208923 0.078581 B\n0.408000 0.163617 0.885452 O\n0.513873 0.910677 0.287575 O\n0.976299 0.763873 0.103195 O\n0.660678 0.873103 0.896805 O\n0.623104 0.226299 0.712426 O\n0.476299 0.373103 0.212426 O\n0.123103 0.410677 0.396805 O\n0.160678 0.263873 0.787575 O\n0.499820 0.499820 -0.000000 O\n0.249820 0.749820 0.500000 O\n0.278166 0.522548 0.114549 O\n0.013873 0.726298 0.603196 O\n0.913617 0.528166 0.255618 O\n0.016225 0.875506 0.423576 O\n0.413617 0.158000 0.385452 O\n0.778166 0.663617 0.755618 O\n0.908000 0.022548 0.244383 O\n0.772549 0.028166 0.614549 O\n0.516226 0.092650 0.140719 O\n0.951931 0.375506 0.859281 O\n0.842650 0.201931 0.076424 O\n0.125506 0.766225 0.923576 O\n0.342650 0.266225 0.640720 O\n0.451931 0.592649 0.576425 O\n-0.000180 -0.000180 -0.000000 O\n0.625506 0.701930 0.359281 O\n0.272548 0.657999 0.744383 O\n0.749820 0.249820 0.500000 O\n",
"nsites": 52,
"nelements": 3,
"elements": [
"Li",
"B",
"O"
],
"chemical_system": "B-Li-O",
"density": 2.4316533635398043,
"density_atomic": 0.11256317335655214,
"volume": 461.962811187689,
"volume_molar": 5.350009759341472,
"formula_full": "Li8 B16 O28",
"formula_reduced": "Li2B4O7",
"formula_anonymous": "A2B4C7",
"energy_above_hull": 3.2200619102564105,
"spacegroup": 110
},
{
"id": "jvasp-120238",
"created_at": "2022-09-04T14:38:52.748642Z",
"updated_at": "2022-09-04T14:38:52.748656Z",
"structure_string": "H1 S1\n1.0\n3.233233 -0.000000 0.000000\n-1.616616 2.800062 -0.000000\n0.000000 -0.000000 2.495934\nH S\n1 1\ndirect\n0.000000 0.000000 0.000000 H\n0.333331 0.666666 0.000000 S\n",
"nsites": 2,
"nelements": 2,
"elements": [
"H",
"S"
],
"chemical_system": "H-S",
"density": 2.430435795204594,
"density_atomic": 0.0885099811019077,
"volume": 22.596321624984427,
"volume_molar": 6.803911474194407,
"formula_full": "H1 S1",
"formula_reduced": "HS",
"formula_anonymous": "AB",
"energy_above_hull": 1.7391949999999998,
"spacegroup": 187
},
{
"id": "jvasp-57039",
"created_at": "2022-09-04T14:37:28.871554Z",
"updated_at": "2022-09-04T14:37:28.871571Z",
"structure_string": "K4 C4 O8\n1.0\n3.386135 0.000000 0.000000\n0.000000 6.140964 0.000000\n0.000000 0.000000 10.923067\nK C O\n4 4 8\ndirect\n0.499999 0.904567 0.849666 K\n0.499999 0.095432 0.150334 K\n0.499999 0.404567 0.650334 K\n0.499999 0.595432 0.349666 K\n0.000000 0.430747 0.938862 C\n0.000000 0.930747 0.561139 C\n0.000000 0.069253 0.438862 C\n0.000000 0.569252 0.061139 C\n0.000000 0.536079 0.838935 O\n0.000000 0.036080 0.661065 O\n0.000000 0.225746 0.950140 O\n0.000000 0.963920 0.338935 O\n0.000000 0.274254 0.450140 O\n0.000000 0.774253 0.049861 O\n0.000000 0.463920 0.161065 O\n0.000000 0.725746 0.549861 O\n",
"nsites": 16,
"nelements": 3,
"elements": [
"K",
"C",
"O"
],
"chemical_system": "C-K-O",
"density": 2.4303311704674595,
"density_atomic": 0.07044246824980767,
"volume": 227.1357094311312,
"volume_molar": 8.549020086354574,
"formula_full": "K4 C4 O8",
"formula_reduced": "KCO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.0580912499999995,
"spacegroup": 55
}
]
}