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=-nelements&page=694",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-nelements&page=692",
"results": [
{
"id": "jvasp-48172",
"created_at": "2022-09-04T14:36:08.859022Z",
"updated_at": "2022-09-04T14:36:08.859050Z",
"structure_string": "Li5 Ti2 Co5 O12\n1.0\n5.028144 0.007586 -0.001870\n-2.515833 -4.408964 0.010575\n-1.888921 0.059361 -9.548883\nLi Ti Co O\n5 2 5 12\ndirect\n0.332049 0.157523 0.993577 Li\n0.819828 0.148275 0.506137 Li\n0.176076 0.858579 0.503614 Li\n0.918208 0.835455 0.749995 Li\n0.687664 0.868234 0.996904 Li\n0.253422 0.505498 0.750068 Ti\n0.753262 0.506071 0.250120 Ti\n0.405345 0.818896 0.245502 Co\n0.499431 0.504993 0.499583 Co\n0.582794 0.165510 0.750015 Co\n0.100447 0.194361 0.254125 Co\n0.011651 0.515671 0.000705 Co\n0.524004 0.829423 0.633825 O\n0.228748 0.182411 0.633464 O\n0.479573 0.183031 0.369470 O\n0.118542 0.511550 0.377234 O\n0.613640 0.479423 0.864953 O\n0.308660 0.833497 0.866349 O\n0.955561 0.187827 0.866567 O\n0.026986 0.832564 0.128166 O\n0.389283 0.504158 0.122696 O\n0.711182 0.185903 0.131119 O\n0.863652 0.475907 0.635078 O\n0.797228 0.829641 0.370677 O\n",
"nsites": 24,
"nelements": 4,
"elements": [
"Li",
"Ti",
"Co",
"O"
],
"chemical_system": "Co-Li-O-Ti",
"density": 4.844562140467135,
"density_atomic": 0.11346520304225868,
"volume": 211.51859210141723,
"volume_molar": 5.307478062465661,
"formula_full": "Li5 Ti2 Co5 O12",
"formula_reduced": "Li5Ti2Co5O12",
"formula_anonymous": "A2B5C5D12",
"energy_above_hull": 2.9217138819444446,
"spacegroup": 5
},
{
"id": "jvasp-99695",
"created_at": "2022-09-04T14:36:39.692693Z",
"updated_at": "2022-09-04T14:36:39.692718Z",
"structure_string": "K2 Lu1 Ag1 Cl6\n1.0\n6.402490 -0.000000 3.696479\n2.134164 6.036325 3.696479\n0.000000 0.000000 7.392958\nK Lu Ag Cl\n2 1 1 6\ndirect\n0.749999 0.750001 0.750000 K\n0.250000 0.250000 0.250000 K\n0.000000 0.000000 0.000000 Lu\n0.500000 0.500000 0.500000 Ag\n0.755872 0.244128 0.244128 Cl\n0.244127 0.244128 0.755873 Cl\n0.244127 0.755873 0.755873 Cl\n0.244127 0.755873 0.244128 Cl\n0.755872 0.244128 0.755873 Cl\n0.755872 0.755873 0.244128 Cl\n",
"nsites": 10,
"nelements": 4,
"elements": [
"K",
"Lu",
"Ag",
"Cl"
],
"chemical_system": "Ag-Cl-K-Lu",
"density": 3.3345089114554636,
"density_atomic": 0.034999370870715245,
"volume": 285.7194215558664,
"volume_molar": 17.206425744752057,
"formula_full": "K2 Lu1 Ag1 Cl6",
"formula_reduced": "K2LuAgCl6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-95094",
"created_at": "2022-09-04T14:36:13.156171Z",
"updated_at": "2022-09-04T14:36:13.156191Z",
"structure_string": "Na2 Te3 Mo3 O16\n1.0\n6.628266 -0.075991 -3.050736\n-3.791317 6.629742 -0.687678\n-0.021667 -0.016236 7.668097\nNa Te Mo O\n2 3 3 16\ndirect\n0.500000 0.913162 0.086837 Na\n-0.000001 0.514316 0.485683 Na\n-0.000001 0.003850 0.996150 Te\n0.502453 0.394097 0.050892 Te\n0.497546 0.949107 0.605902 Te\n0.986704 0.489598 0.972282 Mo\n0.013295 0.027717 0.510401 Mo\n0.500000 0.422062 0.577937 Mo\n0.367106 0.569913 0.536450 O\n0.654969 0.934736 0.876098 O\n0.345031 0.123901 0.065263 O\n0.078274 0.289789 0.043371 O\n0.187284 0.706642 0.186193 O\n0.921725 0.956629 0.710210 O\n0.335660 0.294052 0.755996 O\n0.122462 0.555493 0.829810 O\n0.664339 0.244003 0.705948 O\n0.812715 0.813806 0.293357 O\n0.773501 0.379979 0.112536 O\n0.770864 0.597151 0.844575 O\n0.877538 0.170190 0.444506 O\n0.229135 0.155425 0.402849 O\n0.632894 0.463549 0.430086 O\n0.226498 0.887463 0.620021 O\n",
"nsites": 24,
"nelements": 4,
"elements": [
"Na",
"Te",
"Mo",
"O"
],
"chemical_system": "Mo-Na-O-Te",
"density": 4.834616535310578,
"density_atomic": 0.07184464527634007,
"volume": 334.05412341709615,
"volume_molar": 8.38217063615069,
"formula_full": "Na2 Te3 Mo3 O16",
"formula_reduced": "Na2Te3Mo3O16",
"formula_anonymous": "A2B3C3D16",
"energy_above_hull": 3.000239375,
"spacegroup": 5
},
{
"id": "jvasp-60706",
"created_at": "2022-09-04T14:36:21.801213Z",
"updated_at": "2022-09-04T14:36:21.801234Z",
"structure_string": "Cu4 Hg4 Se4 Br4\n1.0\n4.328943 0.000000 0.000000\n0.000000 9.806193 0.000000\n0.000000 -0.000000 10.036397\nCu Hg Se Br\n4 4 4 4\ndirect\n0.000000 0.216396 0.107811 Cu\n0.000000 0.216396 0.392189 Cu\n0.000000 0.783603 0.607811 Cu\n0.000000 0.783603 0.892189 Cu\n0.500000 0.784143 0.250000 Hg\n0.500000 0.500000 0.500000 Hg\n0.500000 0.215857 0.750000 Hg\n0.500000 0.500000 0.000000 Hg\n0.500000 0.759412 0.503833 Se\n0.500000 0.240587 0.496167 Se\n0.500000 0.759412 -0.003833 Se\n0.500000 0.240587 0.003833 Se\n0.000000 0.987624 0.750000 Br\n0.000000 0.012375 0.250000 Br\n0.000000 0.553478 0.750000 Br\n0.000000 0.446522 0.250000 Br\n",
"nsites": 16,
"nelements": 4,
"elements": [
"Cu",
"Hg",
"Se",
"Br"
],
"chemical_system": "Br-Cu-Hg-Se",
"density": 6.594613089476127,
"density_atomic": 0.03755431517379472,
"volume": 426.0495744884399,
"volume_molar": 16.03581567692181,
"formula_full": "Cu4 Hg4 Se4 Br4",
"formula_reduced": "CuHgSeBr",
"formula_anonymous": "ABCD",
"energy_above_hull": 0.0,
"spacegroup": 51
},
{
"id": "jvasp-99717",
"created_at": "2022-09-04T14:36:19.461742Z",
"updated_at": "2022-09-04T14:36:19.461765Z",
"structure_string": "Rb2 Sm1 Ag1 Cl6\n1.0\n6.563433 -0.000000 3.789399\n2.187811 6.188064 3.789399\n0.000000 0.000000 7.578800\nRb Sm Ag Cl\n2 1 1 6\ndirect\n0.750000 0.750000 0.750001 Rb\n0.250000 0.250000 0.250000 Rb\n0.000000 0.000000 0.000000 Sm\n0.500000 0.500000 0.500000 Ag\n0.750744 0.249255 0.249256 Cl\n0.249255 0.249255 0.750745 Cl\n0.249255 0.750744 0.750745 Cl\n0.249255 0.750744 0.249256 Cl\n0.750744 0.249255 0.750745 Cl\n0.750744 0.750744 0.249256 Cl\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Rb",
"Sm",
"Ag",
"Cl"
],
"chemical_system": "Ag-Cl-Rb-Sm",
"density": 3.462723862609206,
"density_atomic": 0.03248730610659141,
"volume": 307.8125335227805,
"volume_molar": 18.536904045664027,
"formula_full": "Rb2 Sm1 Ag1 Cl6",
"formula_reduced": "Rb2SmAgCl6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-19406",
"created_at": "2022-09-04T14:36:37.483464Z",
"updated_at": "2022-09-04T14:36:37.483493Z",
"structure_string": "Ca4 Ta2 Ag2 O12\n1.0\n0.000000 5.918131 0.079314\n7.566049 0.000000 0.000000\n0.000000 -1.237581 -5.873872\nCa Ta Ag O\n4 2 2 12\ndirect\n0.972774 0.750000 0.930153 Ca\n0.464485 0.750000 0.448345 Ca\n0.535515 0.250000 0.551655 Ca\n0.027226 0.250000 0.069847 Ca\n0.000000 0.000000 0.500000 Ta\n0.000000 0.500000 0.500000 Ta\n0.500000 0.000000 0.000000 Ag\n0.500000 0.500000 0.000000 Ag\n0.830417 0.953451 0.171900 O\n0.387845 0.750000 0.056526 O\n0.169583 0.046549 0.828100 O\n0.732990 0.949727 0.633823 O\n0.267010 0.449727 0.366177 O\n0.732990 0.550274 0.633823 O\n0.267010 0.050273 0.366177 O\n0.830417 0.546549 0.171900 O\n0.612155 0.250000 0.943475 O\n0.169583 0.453451 0.828100 O\n0.893994 0.250000 0.452147 O\n0.106007 0.750000 0.547854 O\n",
"nsites": 20,
"nelements": 4,
"elements": [
"Ca",
"Ta",
"Ag",
"O"
],
"chemical_system": "Ag-Ca-O-Ta",
"density": 5.887791801790818,
"density_atomic": 0.07625702070861136,
"volume": 262.27093340589283,
"volume_molar": 7.897162391134366,
"formula_full": "Ca4 Ta2 Ag2 O12",
"formula_reduced": "Ca2TaAgO6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 2.14906683,
"spacegroup": 11
},
{
"id": "jvasp-49798",
"created_at": "2022-09-04T14:36:35.257100Z",
"updated_at": "2022-09-04T14:36:35.257109Z",
"structure_string": "Li4 Cu2 P2 O8\n1.0\n5.015690 -0.013185 0.016777\n-0.043693 5.271990 -0.056889\n0.020551 -0.105909 6.226106\nLi Cu P O\n4 2 2 8\ndirect\n0.495412 0.160642 0.001869 Li\n-0.000179 0.327082 0.752067 Li\n0.490095 0.673107 0.745410 Li\n0.482781 0.674850 0.249150 Li\n-0.006769 0.787114 0.491051 Cu\n0.016930 0.359922 0.274084 Cu\n0.991826 0.835129 0.990030 P\n0.503441 0.172770 0.507336 P\n0.892437 0.111875 0.986446 O\n0.300734 0.823541 0.998825 O\n0.885613 0.680459 0.790202 O\n0.391187 0.312934 0.711274 O\n0.812697 0.178414 0.514113 O\n0.407125 0.890827 0.501772 O\n0.416567 0.307109 0.297535 O\n0.862694 0.704214 0.188842 O\n",
"nsites": 16,
"nelements": 4,
"elements": [
"Li",
"Cu",
"P",
"O"
],
"chemical_system": "Cu-Li-O-P",
"density": 3.4784575814520955,
"density_atomic": 0.09720574808360502,
"volume": 164.59931964351193,
"volume_molar": 6.195251699334137,
"formula_full": "Li4 Cu2 P2 O8",
"formula_reduced": "Li2CuPO4",
"formula_anonymous": "ABC2D4",
"energy_above_hull": 1.7153274937499998,
"spacegroup": 1
},
{
"id": "jvasp-102871",
"created_at": "2022-09-04T14:36:34.813124Z",
"updated_at": "2022-09-04T14:36:34.813146Z",
"structure_string": "K2 Pr1 Ag1 Cl6\n1.0\n6.616996 -0.000000 3.820324\n2.205666 6.238563 3.820324\n0.000000 -0.000000 7.640648\nK Pr Ag Cl\n2 1 1 6\ndirect\n0.750001 0.750000 0.749999 K\n0.250000 0.250000 0.250000 K\n0.500001 0.500000 0.499999 Pr\n0.000000 0.000000 0.000000 Ag\n0.752217 0.247784 0.247783 Cl\n0.247784 0.247784 0.752216 Cl\n0.247785 0.752216 0.752215 Cl\n0.247785 0.752216 0.247783 Cl\n0.752217 0.247784 0.752215 Cl\n0.752217 0.752216 0.247783 Cl\n",
"nsites": 10,
"nelements": 4,
"elements": [
"K",
"Pr",
"Ag",
"Cl"
],
"chemical_system": "Ag-Cl-K-Pr",
"density": 2.8413072590788953,
"density_atomic": 0.0317047527198156,
"volume": 315.41012441803275,
"volume_molar": 18.994441663745064,
"formula_full": "K2 Pr1 Ag1 Cl6",
"formula_reduced": "K2PrAgCl6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-99743",
"created_at": "2022-09-04T14:36:34.797553Z",
"updated_at": "2022-09-04T14:36:34.797580Z",
"structure_string": "Mg1 Al1 Cu3 Se4\n1.0\n5.777052 0.000000 0.000000\n-0.000000 5.777052 -0.000000\n-0.000000 -0.000000 5.777052\nMg Al Cu Se\n1 1 3 4\ndirect\n0.500000 0.500000 0.500000 Mg\n0.000000 0.000000 0.000000 Al\n0.000000 0.500000 0.000000 Cu\n0.000000 0.000000 0.500000 Cu\n0.500000 0.000000 0.000000 Cu\n0.243117 0.243117 0.243117 Se\n0.756883 0.756883 0.243117 Se\n0.243117 0.756883 0.756883 Se\n0.756883 0.243117 0.756883 Se\n",
"nsites": 9,
"nelements": 4,
"elements": [
"Mg",
"Al",
"Cu",
"Se"
],
"chemical_system": "Al-Cu-Mg-Se",
"density": 4.80375850865041,
"density_atomic": 0.04667922955244666,
"volume": 192.8052387815872,
"volume_molar": 12.901114302312545,
"formula_full": "Mg1 Al1 Cu3 Se4",
"formula_reduced": "MgAlCu3Se4",
"formula_anonymous": "ABC3D4",
"energy_above_hull": 0.6229262962962963,
"spacegroup": 215
},
{
"id": "jvasp-97595",
"created_at": "2022-09-04T14:36:10.660422Z",
"updated_at": "2022-09-04T14:36:10.660439Z",
"structure_string": "Mg3 V6 Fe4 O24\n1.0\n6.325012 -0.114201 -1.706893\n-2.380235 7.226612 -2.172153\n0.021176 -0.127235 9.662978\nMg V Fe O\n3 6 4 24\ndirect\n0.000000 0.500000 0.500000 Mg\n0.276525 0.291575 0.796954 Mg\n0.723475 0.708425 0.203047 Mg\n0.784319 0.343741 0.734671 V\n0.600789 0.254104 0.130181 V\n0.118287 0.105486 0.337838 V\n0.399211 0.745897 0.869820 V\n0.881713 0.894514 0.662163 V\n0.215681 0.656260 0.265330 V\n0.955881 0.803550 0.987789 Fe\n0.376704 0.962416 0.601435 Fe\n0.623296 0.037584 0.398566 Fe\n0.044118 0.196450 0.012212 Fe\n0.874319 0.983817 0.355719 O\n0.766112 0.188326 0.027746 O\n0.233888 0.811674 0.972255 O\n0.009496 0.718753 0.154100 O\n0.990504 0.281247 0.845901 O\n0.838505 0.669909 0.577831 O\n0.435734 0.875817 0.758631 O\n0.161495 0.330092 0.422170 O\n0.254184 0.516662 0.742214 O\n0.745816 0.483339 0.257787 O\n0.793176 0.290681 0.543917 O\n0.206823 0.709319 0.456084 O\n0.651705 0.959209 0.569821 O\n0.348294 0.040792 0.430180 O\n0.657887 0.763103 0.004568 O\n0.342113 0.236897 0.995433 O\n0.477322 0.776918 0.266406 O\n0.522677 0.223083 0.733595 O\n0.125681 0.016183 0.644282 O\n0.081087 0.056186 0.139475 O\n0.918913 0.943815 0.860526 O\n0.564266 0.124183 0.241370 O\n0.172010 0.428365 0.172154 O\n0.827990 0.571635 0.827847 O\n",
"nsites": 37,
"nelements": 4,
"elements": [
"Mg",
"V",
"Fe",
"O"
],
"chemical_system": "Fe-Mg-O-V",
"density": 3.7459307776559436,
"density_atomic": 0.084657700695676,
"volume": 437.05415686880116,
"volume_molar": 7.11351797947849,
"formula_full": "Mg3 V6 Fe4 O24",
"formula_reduced": "Mg3V6(FeO6)4",
"formula_anonymous": "A3B4C6D24",
"energy_above_hull": 3.2699091445945947,
"spacegroup": 2
},
{
"id": "jvasp-89922",
"created_at": "2022-09-04T14:36:16.317882Z",
"updated_at": "2022-09-04T14:36:16.317920Z",
"structure_string": "Pr2 Fe2 S2 O3\n1.0\n4.002050 -0.000000 -0.000000\n-0.000000 4.002050 -0.000000\n-2.001025 -2.001025 8.902076\nPr Fe S O\n2 2 2 3\ndirect\n0.319629 0.319629 0.639257 Pr\n0.680372 0.680372 0.360743 Pr\n0.000000 0.500000 0.000000 Fe\n0.500000 0.000000 0.000000 Fe\n0.906308 0.906308 0.812615 S\n0.093694 0.093694 0.187386 S\n0.750001 0.250001 0.500000 O\n0.250001 0.750001 0.500000 O\n0.500000 0.500000 0.000000 O\n",
"nsites": 9,
"nelements": 4,
"elements": [
"Pr",
"Fe",
"S",
"O"
],
"chemical_system": "Fe-O-Pr-S",
"density": 5.888824601790002,
"density_atomic": 0.0631227907321551,
"volume": 142.57924745737438,
"volume_molar": 9.540358862702005,
"formula_full": "Pr2 Fe2 S2 O3",
"formula_reduced": "Pr2Fe2S2O3",
"formula_anonymous": "A2B2C2D3",
"energy_above_hull": 2.564630133333333,
"spacegroup": 139
},
{
"id": "jvasp-100840",
"created_at": "2022-09-04T14:36:39.219573Z",
"updated_at": "2022-09-04T14:36:39.219582Z",
"structure_string": "Er1 B1 Pt1 Rh2\n1.0\n4.220624 -0.000000 0.000000\n0.000000 4.220624 0.000000\n-0.000000 0.000000 4.206128\nEr B Pt Rh\n1 1 1 2\ndirect\n0.000000 0.000000 0.000000 Er\n0.500000 0.500000 0.500000 B\n0.500000 0.500000 -0.000000 Pt\n-0.000000 0.500000 0.500000 Rh\n0.500000 0.000000 0.500000 Rh\n",
"nsites": 5,
"nelements": 4,
"elements": [
"Er",
"B",
"Pt",
"Rh"
],
"chemical_system": "B-Er-Pt-Rh",
"density": 12.831150367212636,
"density_atomic": 0.06673200767817,
"volume": 74.92656333844496,
"volume_molar": 9.024366221743422,
"formula_full": "Er1 B1 Pt1 Rh2",
"formula_reduced": "ErBPtRh2",
"formula_anonymous": "ABCD2",
"energy_above_hull": 2.860613996666667,
"spacegroup": 123
}
]
}