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=volume&page=3861",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=volume&page=3859",
"results": [
{
"id": "jvasp-10531",
"created_at": "2022-09-04T14:37:19.532600Z",
"updated_at": "2022-09-04T14:37:19.532636Z",
"structure_string": "Na6 Ag2 S4\n1.0\n5.840973 -0.000000 -2.597436\n-1.356292 6.089687 -3.049957\n-0.014243 -0.039183 7.834121\nNa Ag S\n6 2 4\ndirect\n0.500000 0.750000 -0.000000 Na\n0.500000 0.250000 -0.000000 Na\n0.768392 0.518393 0.536784 Na\n0.231609 0.981609 0.463216 Na\n0.231608 0.481608 0.463216 Na\n0.768392 0.018392 0.536784 Na\n0.000000 0.500000 0.000000 Ag\n0.000000 0.000000 0.000000 Ag\n0.140188 0.368112 0.736222 S\n0.403965 0.131889 0.263778 S\n0.596035 0.868112 0.736222 S\n0.859813 0.631889 0.263777 S\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Na",
"Ag",
"S"
],
"chemical_system": "Ag-Na-S",
"density": 2.88286596006783,
"density_atomic": 0.04322829604380062,
"volume": 277.5959521476656,
"volume_molar": 13.931015818662225,
"formula_full": "Na6 Ag2 S4",
"formula_reduced": "Na3AgS2",
"formula_anonymous": "AB2C3",
"energy_above_hull": 0.0966407100000001,
"spacegroup": 72
},
{
"id": "jvasp-20168",
"created_at": "2022-09-04T14:37:31.659741Z",
"updated_at": "2022-09-04T14:37:31.659764Z",
"structure_string": "Th2 Be26\n1.0\n6.341315 -0.000000 3.661160\n2.113771 5.978649 3.661160\n-0.000000 0.000000 7.322319\nTh Be\n2 26\ndirect\n0.750000 0.750000 0.750000 Th\n0.250000 0.250000 0.250000 Th\n0.062492 0.287072 0.712928 Be\n0.712929 0.937508 0.062492 Be\n0.937508 0.712928 0.287071 Be\n0.212928 0.562492 0.437508 Be\n0.562493 0.437508 0.212928 Be\n0.437508 0.212928 0.562492 Be\n0.212928 0.437508 0.787072 Be\n0.212928 0.787072 0.562492 Be\n0.787072 0.437508 0.562492 Be\n0.287072 0.712928 0.062492 Be\n0.287072 0.937508 0.712928 Be\n0.937509 0.062492 0.712928 Be\n0.000000 0.000000 0.000000 Be\n0.712929 0.287072 0.937508 Be\n0.062492 0.937508 0.287072 Be\n0.937508 0.287072 0.062492 Be\n0.787072 0.562492 0.212928 Be\n0.562492 0.787072 0.437508 Be\n0.562493 0.212928 0.787072 Be\n0.437508 0.787072 0.212928 Be\n0.787072 0.212928 0.437508 Be\n0.437508 0.562492 0.787072 Be\n0.287072 0.062492 0.937508 Be\n0.500000 0.500000 0.500000 Be\n0.062492 0.712928 0.937508 Be\n0.712929 0.062492 0.287071 Be\n",
"nsites": 28,
"nelements": 2,
"elements": [
"Th",
"Be"
],
"chemical_system": "Be-Th",
"density": 4.177513421297504,
"density_atomic": 0.1008618667876954,
"volume": 277.6073940703212,
"volume_molar": 5.97068143967237,
"formula_full": "Th2 Be26",
"formula_reduced": "ThBe13",
"formula_anonymous": "AB13",
"energy_above_hull": 2.396351064285714,
"spacegroup": 226
},
{
"id": "jvasp-90171",
"created_at": "2022-09-04T14:38:10.989018Z",
"updated_at": "2022-09-04T14:38:10.989044Z",
"structure_string": "Pt1 I6 N2\n1.0\n-5.177662 -5.177662 -0.000000\n-5.177662 -0.000000 -5.177662\n-0.000000 -5.177662 -5.177662\nPt I N\n1 6 2\ndirect\n0.000000 0.000000 0.000000 Pt\n0.744112 0.744112 0.255887 I\n0.744112 0.255887 0.255887 I\n0.744112 0.255887 0.744112 I\n0.255887 0.744112 0.744112 I\n0.255887 0.744112 0.255887 I\n0.255887 0.255887 0.744112 I\n0.250000 0.250000 0.250000 N\n0.750000 0.750000 0.750000 N\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Pt",
"I",
"N"
],
"chemical_system": "I-N-Pt",
"density": 5.889038832496893,
"density_atomic": 0.03241988167888074,
"volume": 277.6074289581033,
"volume_molar": 18.575455702304424,
"formula_full": "Pt1 I6 N2",
"formula_reduced": "Pt(I3N)2",
"formula_anonymous": "AB2C6",
"energy_above_hull": 1.620736172222222,
"spacegroup": 225
},
{
"id": "jvasp-9555",
"created_at": "2022-09-04T14:37:07.921325Z",
"updated_at": "2022-09-04T14:37:07.921351Z",
"structure_string": "Ca4 Sb4 O10\n1.0\n4.263723 0.000000 0.000000\n0.000000 6.403400 0.000000\n0.000000 0.000000 10.168807\nCa Sb O\n4 4 10\ndirect\n0.500000 0.154821 0.860881 Ca\n0.500000 0.845179 0.139119 Ca\n0.500000 0.654821 0.639119 Ca\n0.500000 0.345179 0.360881 Ca\n0.000000 0.216343 0.605184 Sb\n0.000000 0.783657 0.394816 Sb\n0.000000 0.283657 0.105184 Sb\n0.000000 0.716343 0.894816 Sb\n0.500000 0.286174 0.616176 O\n0.000000 0.814704 0.709294 O\n0.500000 0.786174 0.883825 O\n0.500000 0.213826 0.116175 O\n0.000000 0.500000 0.500000 O\n0.000000 0.685296 0.209294 O\n0.000000 0.185296 0.290706 O\n0.000000 0.000000 0.000000 O\n0.000000 0.314704 0.790706 O\n0.500000 0.713826 0.383825 O\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Ca",
"Sb",
"O"
],
"chemical_system": "Ca-O-Sb",
"density": 4.8287995405577,
"density_atomic": 0.06483401042576543,
"volume": 277.63206196553114,
"volume_molar": 9.288551981363728,
"formula_full": "Ca4 Sb4 O10",
"formula_reduced": "Ca2Sb2O5",
"formula_anonymous": "A2B2C5",
"energy_above_hull": 1.6554445044444444,
"spacegroup": 55
},
{
"id": "jvasp-119017",
"created_at": "2022-09-04T14:38:49.919510Z",
"updated_at": "2022-09-04T14:38:49.919530Z",
"structure_string": "Tm4 Si4 Pd8\n1.0\n5.493869 0.000000 0.000000\n0.000000 6.979837 0.000000\n-0.000000 0.000000 7.240334\nTm Si Pd\n4 4 8\ndirect\n0.358675 0.750000 0.026999 Tm\n0.141325 0.750000 0.526999 Tm\n0.641325 0.250000 0.973000 Tm\n0.858675 0.250000 0.473000 Tm\n0.641426 0.750000 0.379504 Si\n0.858575 0.750000 0.879504 Si\n0.358575 0.250000 0.620496 Si\n0.141426 0.250000 0.120496 Si\n0.908099 0.550650 0.181105 Pd\n0.591901 0.949351 0.681105 Pd\n0.091901 0.050649 0.818894 Pd\n0.408099 0.449351 0.318894 Pd\n0.091901 0.449351 0.818894 Pd\n0.408099 0.050649 0.318894 Pd\n0.908099 0.949351 0.181105 Pd\n0.591901 0.550650 0.681105 Pd\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Tm",
"Si",
"Pd"
],
"chemical_system": "Pd-Si-Tm",
"density": 9.805328230426483,
"density_atomic": 0.05762856448811335,
"volume": 277.64009293169556,
"volume_molar": 10.449923251588448,
"formula_full": "Tm4 Si4 Pd8",
"formula_reduced": "TmSiPd2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.7094810625,
"spacegroup": 62
},
{
"id": "jvasp-103564",
"created_at": "2022-09-04T14:36:43.610575Z",
"updated_at": "2022-09-04T14:36:43.610585Z",
"structure_string": "K2 Cu1 Bi1 Cl6\n1.0\n6.341866 -0.000000 3.661478\n2.113955 5.979168 3.661478\n-0.000000 -0.000000 7.322956\nK Cu Bi Cl\n2 1 1 6\ndirect\n0.750001 0.750000 0.750000 K\n0.250000 0.250000 0.250000 K\n0.500001 0.500000 0.500000 Cu\n0.000000 0.000000 0.000000 Bi\n0.738341 0.261660 0.261660 Cl\n0.261660 0.261660 0.738341 Cl\n0.261660 0.738340 0.738341 Cl\n0.261660 0.738340 0.261660 Cl\n0.738341 0.261660 0.738341 Cl\n0.738341 0.738340 0.261660 Cl\n",
"nsites": 10,
"nelements": 4,
"elements": [
"K",
"Cu",
"Bi",
"Cl"
],
"chemical_system": "Bi-Cl-Cu-K",
"density": 3.3694056622516717,
"density_atomic": 0.03601270617976457,
"volume": 277.67977085873565,
"volume_molar": 16.72226666315852,
"formula_full": "K2 Cu1 Bi1 Cl6",
"formula_reduced": "K2CuBiCl6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-43565",
"created_at": "2022-09-04T14:36:05.335332Z",
"updated_at": "2022-09-04T14:36:05.335358Z",
"structure_string": "Li3 V2 P4 H2 O16\n1.0\n4.845402 -0.008293 -0.009861\n1.893135 7.216016 -0.030518\n0.058206 0.043004 7.938686\nLi V P H O\n3 2 4 2 16\ndirect\n0.385509 0.155367 0.867038 Li\n0.607273 0.842388 0.131588 Li\n0.897055 0.647118 0.627867 Li\n0.493317 0.006984 0.501545 V\n0.002657 0.496606 0.003295 V\n0.634501 0.239818 0.160108 P\n0.869265 0.265518 0.654031 P\n0.130873 0.738150 0.345670 P\n0.371217 0.763920 0.845919 P\n0.466805 0.510423 0.491001 H\n0.974319 0.012111 0.011489 H\n0.651670 0.145392 0.680398 O\n0.848548 0.358453 0.172518 O\n0.741111 0.446362 0.563700 O\n0.623754 0.651756 0.953795 O\n0.485909 0.808134 0.673077 O\n0.762403 0.052760 0.061248 O\n0.350161 0.855114 0.321781 O\n0.149797 0.647091 0.825185 O\n0.543526 0.184338 0.332202 O\n0.378949 0.338110 0.049370 O\n0.254104 0.557898 0.447336 O\n0.987348 0.307802 0.827224 O\n0.020998 0.690322 0.174435 O\n0.127168 0.142515 0.555168 O\n0.251777 0.945296 0.943079 O\n0.874423 0.845558 0.452903 O\n",
"nsites": 27,
"nelements": 5,
"elements": [
"Li",
"V",
"P",
"H",
"O"
],
"chemical_system": "H-Li-O-P-V",
"density": 3.017286650714753,
"density_atomic": 0.09722494024385603,
"volume": 277.70652193027416,
"volume_molar": 6.194028759385696,
"formula_full": "Li3 V2 P4 H2 O16",
"formula_reduced": "Li3V2P4(HO8)2",
"formula_anonymous": "A2B2C3D4E16",
"energy_above_hull": 3.068923940740741,
"spacegroup": 1
},
{
"id": "jvasp-120586",
"created_at": "2022-09-04T14:38:46.811790Z",
"updated_at": "2022-09-04T14:38:46.811817Z",
"structure_string": "Li4 V4 F16\n1.0\n5.040574 0.000000 0.000000\n-0.000000 6.922504 1.832225\n-0.000000 -0.008033 7.956598\nLi V F\n4 4 16\ndirect\n0.794588 0.007443 0.136740 Li\n0.705410 0.507443 0.136739 Li\n0.294589 0.492557 0.863260 Li\n0.205411 -0.007443 0.863260 Li\n0.278205 0.768436 0.329487 V\n0.221794 0.268436 0.329487 V\n0.778205 0.731564 0.670512 V\n0.721794 0.231564 0.670513 V\n0.401413 0.261932 0.793848 F\n0.098587 0.761932 0.793848 F\n0.906779 0.473051 0.673582 F\n0.043002 0.167810 0.553042 F\n0.593219 0.973051 0.673581 F\n0.456998 0.667810 0.553041 F\n0.543002 0.332190 0.446958 F\n0.901412 0.238068 0.206152 F\n0.956997 0.832190 0.446958 F\n0.093220 0.526949 0.326418 F\n0.626083 0.618217 0.890321 F\n0.598587 0.738067 0.206151 F\n0.373916 0.381783 0.109679 F\n0.126084 0.881783 0.109679 F\n0.406780 0.026949 0.326418 F\n0.873916 0.118217 0.890321 F\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Li",
"V",
"F"
],
"chemical_system": "F-Li-V",
"density": 3.202030911266838,
"density_atomic": 0.08642205305583295,
"volume": 277.7068948419312,
"volume_molar": 6.968291711502615,
"formula_full": "Li4 V4 F16",
"formula_reduced": "LiVF4",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.3184542216666666,
"spacegroup": 14
},
{
"id": "jvasp-103806",
"created_at": "2022-09-04T14:36:42.244463Z",
"updated_at": "2022-09-04T14:36:42.244491Z",
"structure_string": "H12 C10 S2 N4\n1.0\n4.333359 -0.066168 0.890224\n1.831303 6.576795 1.293960\n-0.156414 0.022777 9.674732\nH C S N\n12 10 2 4\ndirect\n0.075617 0.850409 0.151630 H\n0.009543 0.711576 0.408240 H\n0.509545 0.211576 0.908240 H\n0.748159 0.915199 0.761220 H\n0.985364 0.212988 0.650484 H\n0.485362 0.712989 0.150484 H\n0.248157 0.415199 0.261220 H\n0.180717 0.735982 0.904901 H\n0.451345 0.078071 0.229507 H\n0.951346 0.578071 0.729506 H\n0.575619 0.350409 0.651630 H\n0.680718 0.235981 0.404901 H\n0.860071 0.348752 0.903503 C\n0.740003 0.217272 0.703697 C\n0.240000 0.717273 0.203698 C\n0.360069 0.848751 0.403504 C\n0.573441 -0.000545 0.571813 C\n0.463244 0.017073 0.340823 C\n0.585727 0.103310 0.436193 C\n0.085726 0.603311 0.936193 C\n0.963244 0.517072 0.840823 C\n0.073439 0.499455 0.071813 C\n0.923433 0.288145 0.081938 S\n0.423433 0.788146 0.581938 S\n0.729549 0.218210 0.854666 N\n0.136582 0.538603 0.197321 N\n0.636583 0.038604 0.697320 N\n0.229549 0.718211 0.354666 N\n",
"nsites": 28,
"nelements": 4,
"elements": [
"H",
"C",
"S",
"N"
],
"chemical_system": "C-H-N-S",
"density": 1.5088089094941788,
"density_atomic": 0.10081478732985147,
"volume": 277.73703383798284,
"volume_molar": 5.973469685847199,
"formula_full": "H12 C10 S2 N4",
"formula_reduced": "H6C5SN2",
"formula_anonymous": "AB2C5D6",
"energy_above_hull": 5.106681892857143,
"spacegroup": 1
},
{
"id": "jvasp-111869",
"created_at": "2022-09-04T14:38:42.297786Z",
"updated_at": "2022-09-04T14:38:42.297811Z",
"structure_string": "Li4 V6 Co2 O16\n1.0\n5.759242 0.001788 -0.000616\n2.878090 4.835392 -1.663302\n0.000783 0.000896 9.975496\nLi V Co O\n4 6 2 16\ndirect\n0.320100 0.359843 0.559975 Li\n0.820075 0.359838 0.059975 Li\n0.744943 0.510065 0.751678 Li\n0.244988 0.510065 0.251673 Li\n0.234117 0.001220 0.745051 V\n0.499310 0.001196 0.010414 V\n0.734123 0.001179 0.245050 V\n0.264752 0.001211 0.245136 V\n0.764784 0.001173 0.745133 V\n0.999311 0.001199 0.510414 V\n0.187178 0.625668 0.937614 Co\n0.687159 0.625669 0.437613 Co\n0.120766 0.223775 0.626403 O\n0.107609 0.784780 0.140907 O\n0.607622 0.784781 0.640907 O\n0.872765 0.784779 0.375738 O\n0.372768 0.784785 0.875736 O\n0.620761 0.223757 0.126403 O\n0.388122 0.223776 0.359061 O\n0.622118 0.755724 0.125955 O\n0.155455 0.223779 0.126421 O\n0.655472 0.223768 0.626424 O\n0.890257 0.219463 0.369912 O\n0.390273 0.219463 0.869912 O\n0.842442 0.784769 0.875742 O\n0.122153 0.755727 0.625955 O\n0.888132 0.223774 0.859061 O\n0.342430 0.784780 0.375741 O\n",
"nsites": 28,
"nelements": 4,
"elements": [
"Li",
"V",
"Co",
"O"
],
"chemical_system": "Co-Li-O-V",
"density": 4.2283364160707535,
"density_atomic": 0.10080761945683094,
"volume": 277.7567821844112,
"volume_molar": 5.973894426282802,
"formula_full": "Li4 V6 Co2 O16",
"formula_reduced": "Li2V3CoO8",
"formula_anonymous": "AB2C3D8",
"energy_above_hull": 3.1076322499999995,
"spacegroup": 160
},
{
"id": "jvasp-52511",
"created_at": "2022-09-04T14:38:15.425856Z",
"updated_at": "2022-09-04T14:38:15.425885Z",
"structure_string": "K4 Sn4 O8\n1.0\n6.713895 -0.005146 0.016655\n-1.489395 6.381540 -0.025197\n-3.289666 -1.526019 6.481137\nK Sn O\n4 4 8\ndirect\n0.260278 0.976845 0.257408 K\n0.754308 0.546682 0.009781 K\n0.245486 0.458253 0.989677 K\n0.739526 0.028089 0.742067 K\n0.219456 0.911408 0.742091 Sn\n0.739280 0.511658 0.500578 Sn\n0.260504 0.493279 0.498881 Sn\n0.780336 0.093532 0.257374 Sn\n0.021768 0.701230 0.438911 O\n0.419888 0.701965 0.785736 O\n0.962990 0.716942 0.794922 O\n0.486904 0.677745 0.406997 O\n0.579905 0.302977 0.213724 O\n0.978022 0.303712 0.560551 O\n0.512879 0.327193 0.592459 O\n0.036796 0.287995 0.204536 O\n",
"nsites": 16,
"nelements": 3,
"elements": [
"K",
"Sn",
"O"
],
"chemical_system": "K-O-Sn",
"density": 4.53885586258017,
"density_atomic": 0.057602964068793894,
"volume": 277.7634842000764,
"volume_molar": 10.4545674990056,
"formula_full": "K4 Sn4 O8",
"formula_reduced": "KSnO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.6439741749999999,
"spacegroup": 2
},
{
"id": "jvasp-59496",
"created_at": "2022-09-04T14:37:08.157257Z",
"updated_at": "2022-09-04T14:37:08.157285Z",
"structure_string": "Cd4 Re4 O14\n1.0\n6.342636 -0.000000 3.661923\n2.114212 5.979894 3.661923\n0.000000 -0.000000 7.323846\nCd Re O\n4 4 14\ndirect\n0.500000 0.000000 0.500000 Cd\n-0.000000 0.500000 0.500000 Cd\n0.500000 0.500000 -0.000000 Cd\n0.500000 0.500000 0.500000 Cd\n-0.000000 0.500000 0.000000 Re\n0.000000 0.000000 0.500000 Re\n0.000000 0.000000 0.000000 Re\n0.500000 0.000000 -0.000000 Re\n0.065124 0.684876 0.065124 O\n0.684877 0.065124 0.684876 O\n0.684877 0.065124 0.065123 O\n0.625000 0.625000 0.625000 O\n0.934877 0.315124 0.315123 O\n0.315124 0.934876 0.315124 O\n0.315124 0.315124 0.934877 O\n0.934877 0.934876 0.315123 O\n0.934877 0.315124 0.934876 O\n0.065124 0.684876 0.684877 O\n0.315124 0.934876 0.934877 O\n0.375000 0.375000 0.375000 O\n0.684877 0.684876 0.065123 O\n0.065124 0.065124 0.684877 O\n",
"nsites": 22,
"nelements": 3,
"elements": [
"Cd",
"Re",
"O"
],
"chemical_system": "Cd-O-Re",
"density": 8.479393998295462,
"density_atomic": 0.07919909211398764,
"volume": 277.7809620385093,
"volume_molar": 7.603800244745997,
"formula_full": "Cd4 Re4 O14",
"formula_reduced": "Cd2Re2O7",
"formula_anonymous": "A2B2C7",
"energy_above_hull": 2.830293636363636,
"spacegroup": 227
}
]
}