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_molar&page=4154",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-volume_molar&page=4152",
"results": [
{
"id": "jvasp-14264",
"created_at": "2022-09-04T14:37:04.104186Z",
"updated_at": "2022-09-04T14:37:04.104218Z",
"structure_string": "Ta4 Sn2 O14\n1.0\n4.767783 -0.000000 -1.353283\n0.070904 5.182742 0.249804\n-0.119912 0.553954 8.652923\nTa Sn O\n4 2 14\ndirect\n0.610036 0.803557 0.675493 Ta\n0.065457 0.303557 0.675493 Ta\n0.389963 0.196442 0.324506 Ta\n0.934542 0.696442 0.324506 Ta\n0.769956 0.250000 0.000000 Sn\n0.230042 0.750000 -0.000000 Sn\n0.691049 0.996798 0.282780 O\n0.408270 0.503201 0.717220 O\n0.905455 0.027845 0.838314 O\n0.067141 0.472154 0.161686 O\n0.682976 0.164860 0.551889 O\n0.622773 0.750000 -0.000000 O\n0.377226 0.250000 -0.000000 O\n0.591729 0.496798 0.282780 O\n0.308950 0.003201 0.717220 O\n0.868912 0.664860 0.551889 O\n0.317023 0.835139 0.448110 O\n0.131087 0.335139 0.448110 O\n0.932858 0.527845 0.838313 O\n0.094544 0.972154 0.161686 O\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Ta",
"Sn",
"O"
],
"chemical_system": "O-Sn-Ta",
"density": 9.271944540454216,
"density_atomic": 0.09422343599774673,
"volume": 212.26141658088423,
"volume_molar": 6.391340642835414,
"formula_full": "Ta4 Sn2 O14",
"formula_reduced": "Ta2SnO7",
"formula_anonymous": "AB2C7",
"energy_above_hull": 3.42813346,
"spacegroup": 15
},
{
"id": "jvasp-104971",
"created_at": "2022-09-04T14:36:55.201463Z",
"updated_at": "2022-09-04T14:36:55.201483Z",
"structure_string": "Be1 Zn3 O4\n1.0\n4.016016 -0.014638 -3.545254\n-0.826805 3.930012 -3.545254\n0.011923 0.014638 5.356964\nBe Zn O\n1 3 4\ndirect\n0.000000 0.000000 0.000000 Be\n0.500000 0.500000 0.000000 Zn\n0.249999 0.750000 0.499999 Zn\n0.750000 0.250000 0.500000 Zn\n0.670344 0.670344 0.563005 O\n0.107338 0.107338 0.436994 O\n0.892662 0.329655 0.000001 O\n0.329654 0.892661 -0.000000 O\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Be",
"Zn",
"O"
],
"chemical_system": "Be-O-Zn",
"density": 5.2658058497397375,
"density_atomic": 0.09422612710598478,
"volume": 84.90214174887677,
"volume_molar": 6.391158105465108,
"formula_full": "Be1 Zn3 O4",
"formula_reduced": "BeZn3O4",
"formula_anonymous": "AB3C4",
"energy_above_hull": 0.7399089124999998,
"spacegroup": 121
},
{
"id": "jvasp-121056",
"created_at": "2022-09-04T14:38:52.318603Z",
"updated_at": "2022-09-04T14:38:52.318620Z",
"structure_string": "Mn1 Ge1 O4\n1.0\n-1.864730 1.864730 4.578055\n1.864730 -1.864730 4.578055\n1.864730 1.864730 -4.578055\nMn Ge O\n1 1 4\ndirect\n0.000000 0.000000 0.000000 Mn\n0.749999 0.250000 0.499999 Ge\n0.956788 0.456788 0.499999 O\n0.793562 0.793562 0.000000 O\n0.543211 0.043212 0.499999 O\n0.206439 0.206439 0.000000 O\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Mn",
"Ge",
"O"
],
"chemical_system": "Ge-Mn-O",
"density": 4.995931567410368,
"density_atomic": 0.09422764507462254,
"volume": 63.67558050769884,
"volume_molar": 6.391055146534578,
"formula_full": "Mn1 Ge1 O4",
"formula_reduced": "MnGeO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.4269911985632184,
"spacegroup": 119
},
{
"id": "jvasp-45790",
"created_at": "2022-09-04T14:38:00.733482Z",
"updated_at": "2022-09-04T14:38:00.733500Z",
"structure_string": "Li4 V2 F12\n1.0\n0.000000 4.400132 -0.752805\n8.609404 0.000000 0.000000\n0.000000 -0.843999 -4.898056\nLi V F\n4 2 12\ndirect\n0.000068 0.667291 0.750010 Li\n0.500177 0.333940 0.750100 Li\n0.499823 0.833939 0.249902 Li\n-0.000068 0.167292 0.249991 Li\n0.499946 0.000616 0.749908 V\n0.500053 0.500616 0.250094 V\n0.733865 0.157144 0.596002 F\n0.733887 0.657135 0.096120 F\n0.733967 -0.000652 0.061984 F\n0.733932 0.345266 0.092442 F\n0.266135 0.657144 0.404000 F\n0.266068 0.845266 0.907560 F\n0.266196 0.345298 0.407743 F\n0.734107 0.499390 0.562167 F\n0.266033 0.499348 0.938018 F\n0.266113 0.157135 0.903881 F\n0.265893 -0.000610 0.437835 F\n0.733804 0.845298 0.592259 F\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Li",
"V",
"F"
],
"chemical_system": "F-Li-V",
"density": 3.10884985310473,
"density_atomic": 0.094230574200259,
"volume": 191.02080352122618,
"volume_molar": 6.390856482739599,
"formula_full": "Li4 V2 F12",
"formula_reduced": "Li2VF6",
"formula_anonymous": "AB2C6",
"energy_above_hull": 0.2993739883333332,
"spacegroup": 149
},
{
"id": "jvasp-59884",
"created_at": "2022-09-04T14:38:18.835415Z",
"updated_at": "2022-09-04T14:38:18.835450Z",
"structure_string": "Mg2 Ti4 O8\n1.0\n5.868027 0.000521 0.000757\n2.933606 5.159890 -0.000676\n2.933257 1.595586 4.907124\nMg Ti O\n2 4 8\ndirect\n0.000000 0.000000 0.000000 Mg\n0.500000 -0.000000 0.000000 Mg\n0.000000 0.500000 -0.000000 Ti\n0.000001 0.500001 0.499999 Ti\n0.000000 0.000001 0.500000 Ti\n0.500001 0.500001 0.500000 Ti\n0.771006 0.252665 0.252663 O\n0.756614 0.746911 0.239862 O\n0.223667 0.252665 0.252662 O\n0.243387 0.760137 0.253092 O\n0.776335 0.747336 0.747337 O\n0.243388 0.253090 0.760137 O\n0.756615 0.239864 0.746907 O\n0.228996 0.747336 0.747336 O\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Mg",
"Ti",
"O"
],
"chemical_system": "Mg-O-Ti",
"density": 4.113867251280067,
"density_atomic": 0.09423126358891123,
"volume": 148.57064913270955,
"volume_molar": 6.390809727726778,
"formula_full": "Mg2 Ti4 O8",
"formula_reduced": "MgTi2O4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 2.2542556738095234,
"spacegroup": 74
},
{
"id": "jvasp-111738",
"created_at": "2022-09-04T14:38:41.676618Z",
"updated_at": "2022-09-04T14:38:41.676641Z",
"structure_string": "Lu4 Be4 Ge2 O14\n1.0\n7.321962 0.000000 -0.000000\n0.000000 7.321962 0.000000\n0.000000 -0.000000 4.750304\nLu Be Ge O\n4 4 2 14\ndirect\n0.157198 0.342802 0.506959 Lu\n0.842801 0.657198 0.506959 Lu\n0.657198 0.157198 0.493040 Lu\n0.342802 0.842801 0.493040 Lu\n0.636347 0.863652 0.947146 Be\n0.363653 0.136347 0.947146 Be\n0.136347 0.636347 0.052853 Be\n0.863652 0.363653 0.052853 Be\n0.000000 0.000000 0.000000 Ge\n0.500000 0.500000 0.000000 Ge\n0.583734 0.670494 0.773725 O\n0.829505 0.916266 0.773725 O\n0.416266 0.329505 0.773725 O\n0.170495 0.083734 0.773725 O\n0.916266 0.170495 0.226274 O\n0.083734 0.829505 0.226274 O\n0.500000 0.000000 0.804333 O\n0.142530 0.642529 0.718052 O\n0.357470 0.142530 0.281947 O\n0.642529 0.857470 0.281947 O\n0.329505 0.583734 0.226274 O\n0.000000 0.500000 0.195667 O\n0.857470 0.357470 0.718052 O\n0.670494 0.416266 0.226274 O\n",
"nsites": 24,
"nelements": 4,
"elements": [
"Lu",
"Be",
"Ge",
"O"
],
"chemical_system": "Be-Ge-Lu-O",
"density": 7.20624531486934,
"density_atomic": 0.09423991742098263,
"volume": 254.66915354762793,
"volume_molar": 6.390222874557786,
"formula_full": "Lu4 Be4 Ge2 O14",
"formula_reduced": "Lu2Be2GeO7",
"formula_anonymous": "AB2C2D7",
"energy_above_hull": 2.1828086791666665,
"spacegroup": 113
},
{
"id": "jvasp-22879",
"created_at": "2022-09-04T14:37:47.135153Z",
"updated_at": "2022-09-04T14:37:47.135175Z",
"structure_string": "Li8 Zn4 Si4 O16\n1.0\n0.000000 5.069718 -0.008630\n10.688474 0.000000 0.000000\n0.000000 -4.998490 -6.257816\nLi Zn Si O\n8 4 4 16\ndirect\n0.683182 0.663601 0.495092 Li\n0.540991 0.576074 0.741395 Li\n0.459010 0.076074 0.758606 Li\n0.459009 0.423926 0.258605 Li\n0.540991 0.923926 0.241395 Li\n0.316819 0.163601 0.004908 Li\n0.316819 0.336398 0.504908 Li\n0.683182 0.836398 0.995093 Li\n0.190968 0.665785 0.001498 Zn\n0.809033 0.165785 0.498502 Zn\n0.809032 0.334215 -0.001498 Zn\n0.190968 0.834214 0.501499 Zn\n0.065501 0.086688 0.251812 Si\n0.934499 0.586688 0.248188 Si\n0.934500 0.913311 0.748188 Si\n0.065502 0.413312 0.751813 Si\n0.947921 0.941915 0.244940 O\n0.052080 0.441915 0.255060 O\n0.608470 0.911810 0.749130 O\n0.391531 0.411810 0.750871 O\n0.391531 0.088190 0.250870 O\n0.608470 0.588190 0.249130 O\n0.741595 0.340591 0.536362 O\n0.741595 0.159409 0.036362 O\n0.822147 0.839651 0.530539 O\n0.258406 0.840590 0.963639 O\n0.177855 0.339651 0.969462 O\n0.177854 0.160349 0.469461 O\n0.822146 0.660348 0.030539 O\n0.947921 0.558084 0.744940 O\n0.258406 0.659409 0.463638 O\n0.052080 0.058084 0.755060 O\n",
"nsites": 32,
"nelements": 4,
"elements": [
"Li",
"Zn",
"Si",
"O"
],
"chemical_system": "Li-O-Si-Zn",
"density": 3.352292224142598,
"density_atomic": 0.09424049794883466,
"volume": 339.5567796911848,
"volume_molar": 6.3901835103519495,
"formula_full": "Li8 Zn4 Si4 O16",
"formula_reduced": "Li2ZnSiO4",
"formula_anonymous": "ABC2D4",
"energy_above_hull": 1.524409125,
"spacegroup": 14
},
{
"id": "jvasp-95414",
"created_at": "2022-09-04T14:35:57.484575Z",
"updated_at": "2022-09-04T14:35:57.484584Z",
"structure_string": "Ca4 V8 O16\n1.0\n2.976161 -0.000000 0.000000\n0.000000 9.270674 0.000000\n0.000000 0.000000 10.767541\nCa V O\n4 8 16\ndirect\n0.250000 0.242060 0.345147 Ca\n0.250000 0.742060 0.154853 Ca\n0.750000 0.257940 0.845147 Ca\n0.750000 0.757940 0.654853 Ca\n0.250000 0.583438 0.894667 V\n0.750000 0.416562 0.105333 V\n0.750000 0.936403 0.886485 V\n0.750000 0.916562 0.394667 V\n0.250000 0.563596 0.386485 V\n0.750000 0.436404 0.613515 V\n0.250000 0.063596 0.113515 V\n0.250000 0.083438 0.605333 V\n0.750000 0.523747 0.783385 O\n0.250000 0.083038 0.926906 O\n0.750000 0.916961 0.073094 O\n0.250000 0.976252 0.283385 O\n0.750000 0.023747 0.716615 O\n0.250000 0.476253 0.216615 O\n0.250000 0.883205 0.523566 O\n0.250000 0.293224 0.664503 O\n0.250000 0.383205 0.976434 O\n0.750000 0.616795 0.023566 O\n0.250000 0.793224 0.835497 O\n0.750000 0.206776 0.164503 O\n0.750000 0.416962 0.426906 O\n0.750000 0.706776 0.335497 O\n0.750000 0.116795 0.476434 O\n0.250000 0.583038 0.573094 O\n",
"nsites": 28,
"nelements": 3,
"elements": [
"Ca",
"V",
"O"
],
"chemical_system": "Ca-O-V",
"density": 4.604736198349539,
"density_atomic": 0.09424835229554802,
"volume": 297.08742188082397,
"volume_molar": 6.389650973542235,
"formula_full": "Ca4 V8 O16",
"formula_reduced": "CaV2O4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 2.5297761171428568,
"spacegroup": 62
},
{
"id": "jvasp-112405",
"created_at": "2022-09-04T14:38:39.955466Z",
"updated_at": "2022-09-04T14:38:39.955486Z",
"structure_string": "Li4 Mn8 O12 F4\n1.0\n5.867974 0.040253 -0.298586\n-0.157473 6.055480 -0.084399\n-0.028492 0.036834 8.360033\nLi Mn O F\n4 8 12 4\ndirect\n0.209060 0.003244 0.106174 Li\n0.709062 0.503244 0.606171 Li\n0.790941 0.996755 0.893825 Li\n0.290939 0.496754 0.393828 Li\n0.250003 0.749994 0.749998 Mn\n0.749996 0.250005 0.250002 Mn\n0.000001 0.500003 0.000000 Mn\n0.500000 -0.000003 0.500000 Mn\n0.750000 0.750003 0.249995 Mn\n-0.000001 -0.000001 0.500000 Mn\n0.500001 0.500002 0.000001 Mn\n0.249999 0.249996 0.750002 Mn\n0.241778 0.287022 0.979375 O\n0.226733 0.725033 0.975894 O\n0.726724 0.225041 0.475893 O\n0.456778 0.501975 0.764451 O\n0.956774 0.001986 0.264450 O\n0.741783 0.787030 0.479372 O\n0.543222 0.498023 0.235547 O\n0.258216 0.212969 0.520626 O\n0.773267 0.274966 0.024106 O\n0.273278 0.774958 0.524107 O\n0.043225 0.998012 0.735549 O\n0.758223 0.712977 0.020625 O\n0.472882 0.993847 0.233307 F\n0.527118 0.006151 0.766692 F\n0.027114 0.506157 0.266693 F\n0.972886 0.493841 0.733306 F\n",
"nsites": 28,
"nelements": 4,
"elements": [
"Li",
"Mn",
"O",
"F"
],
"chemical_system": "F-Li-Mn-O",
"density": 4.1097055115471735,
"density_atomic": 0.09425009233678996,
"volume": 297.08193706533234,
"volume_molar": 6.389533008074617,
"formula_full": "Li4 Mn8 O12 F4",
"formula_reduced": "LiMn2O3F",
"formula_anonymous": "ABC2D3",
"energy_above_hull": 2.343736466465517,
"spacegroup": 12
},
{
"id": "jvasp-88321",
"created_at": "2022-09-04T14:35:52.280488Z",
"updated_at": "2022-09-04T14:35:52.280512Z",
"structure_string": "B4 H20 C4 S4 N8\n1.0\n9.098947 0.000000 0.000000\n0.000000 6.547418 -0.000000\n0.000000 0.000000 7.123603\nB H C S N\n4 20 4 4 8\ndirect\n0.733742 0.250000 0.819539 B\n0.233742 0.250000 0.680460 B\n0.266258 0.750000 0.180461 B\n0.766258 0.750000 0.319539 B\n0.158837 0.403955 0.675076 H\n0.658837 0.096045 0.824923 H\n0.841163 0.903955 0.324924 H\n0.341163 0.596045 0.175076 H\n0.341163 0.903955 0.175076 H\n0.158837 0.096045 0.675076 H\n0.658837 0.403955 0.824923 H\n0.390757 0.377317 0.882858 H\n0.890757 0.122683 0.617141 H\n0.841163 0.596045 0.324924 H\n0.109243 0.622683 0.382858 H\n0.609243 0.622683 0.117142 H\n0.109243 0.877317 0.382858 H\n0.390757 0.122683 0.882858 H\n0.890757 0.377317 0.617141 H\n0.745218 0.750000 0.011501 H\n0.245218 0.750000 0.488499 H\n0.254783 0.250000 0.988498 H\n0.754783 0.250000 0.511501 H\n0.609243 0.877317 0.117142 H\n0.558349 0.750000 0.587914 C\n0.058349 0.750000 0.912086 C\n0.941652 0.250000 0.087914 C\n0.441651 0.250000 0.412086 C\n0.071945 0.250000 0.240605 S\n0.571946 0.250000 0.259395 S\n0.928055 0.750000 0.759395 S\n0.428055 0.750000 0.740605 S\n0.175889 0.750000 0.372863 N\n0.846037 0.250000 0.976000 N\n0.346037 0.250000 0.523999 N\n0.153963 0.750000 0.024000 N\n0.653964 0.750000 0.476000 N\n0.824111 0.250000 0.627137 N\n0.324111 0.250000 0.872863 N\n0.675890 0.750000 0.127137 N\n",
"nsites": 40,
"nelements": 5,
"elements": [
"B",
"H",
"C",
"S",
"N"
],
"chemical_system": "B-C-H-N-S",
"density": 1.376365096954686,
"density_atomic": 0.09425384585678558,
"volume": 424.38586602373954,
"volume_molar": 6.389278554373652,
"formula_full": "B4 H20 C4 S4 N8",
"formula_reduced": "BH5CSN2",
"formula_anonymous": "ABCD2E5",
"energy_above_hull": 4.237868908333333,
"spacegroup": 62
},
{
"id": "jvasp-42153",
"created_at": "2022-09-04T14:36:34.847990Z",
"updated_at": "2022-09-04T14:36:34.848022Z",
"structure_string": "Ag2 B2 O6\n1.0\n2.426134 1.400729 5.203187\n-2.426134 1.400729 5.203187\n0.000000 -2.801457 5.203187\nAg B O\n2 2 6\ndirect\n0.000000 0.000000 0.000000 Ag\n0.500000 0.500000 0.500000 Ag\n0.250000 0.250000 0.250000 B\n0.750000 0.750000 0.750000 B\n0.250001 0.965386 0.534614 O\n0.034614 0.465386 0.750001 O\n0.465387 0.750000 0.034613 O\n0.534613 0.250000 0.965387 O\n0.965387 0.534614 0.250000 O\n0.750000 0.034614 0.465387 O\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Ag",
"B",
"O"
],
"chemical_system": "Ag-B-O",
"density": 5.217546455695948,
"density_atomic": 0.094256327459207,
"volume": 106.09367317359016,
"volume_molar": 6.389110335967959,
"formula_full": "Ag2 B2 O6",
"formula_reduced": "AgBO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 2.185932068666667,
"spacegroup": 167
},
{
"id": "jvasp-43984",
"created_at": "2022-09-04T14:36:16.124883Z",
"updated_at": "2022-09-04T14:36:16.124910Z",
"structure_string": "Li4 Al2 Fe2 O8\n1.0\n4.982176 0.000000 0.000000\n0.000000 5.474837 0.000000\n0.000000 0.000000 6.223103\nLi Al Fe O\n4 2 2 8\ndirect\n0.006319 0.666271 0.250555 Li\n0.506319 0.333729 0.249445 Li\n0.006319 0.666271 0.749444 Li\n0.506319 0.333729 0.750555 Li\n0.501146 0.830340 0.000000 Al\n0.001145 0.169660 0.500000 Al\n0.003432 0.168166 0.000000 Fe\n0.503432 0.831835 0.500000 Fe\n0.142132 0.845278 0.000000 O\n0.624251 0.137638 0.000000 O\n0.108197 0.322417 0.261125 O\n0.608197 0.677584 0.238875 O\n0.124251 0.862363 0.500000 O\n0.642133 0.154723 0.500000 O\n0.608197 0.677584 0.761124 O\n0.108197 0.322417 0.738875 O\n",
"nsites": 16,
"nelements": 4,
"elements": [
"Li",
"Al",
"Fe",
"O"
],
"chemical_system": "Al-Fe-Li-O",
"density": 3.144230029073597,
"density_atomic": 0.09425897971737403,
"volume": 169.7451006575116,
"volume_molar": 6.388930559249397,
"formula_full": "Li4 Al2 Fe2 O8",
"formula_reduced": "Li2AlFeO4",
"formula_anonymous": "ABC2D4",
"energy_above_hull": 2.0599140375,
"spacegroup": 31
}
]
}