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=4537",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=nelements&page=4535",
"results": [
{
"id": "jvasp-56854",
"created_at": "2022-09-04T14:37:55.019276Z",
"updated_at": "2022-09-04T14:37:55.019301Z",
"structure_string": "Rb2 Li1 Dy1 Br6\n1.0\n6.676258 -0.000000 -3.820785\n-2.186613 6.308023 -3.820785\n-0.029230 -0.041068 7.692206\nRb Li Dy Br\n2 1 1 6\ndirect\n0.750000 0.250000 0.500001 Rb\n0.250000 0.750000 0.500001 Rb\n0.500000 0.500000 0.000001 Li\n0.000000 0.000000 0.000000 Dy\n0.254107 0.745893 0.000001 Br\n0.254107 0.254107 0.508213 Br\n0.745894 0.745893 0.000001 Br\n0.254107 0.254106 0.000000 Br\n0.745893 0.745893 0.491788 Br\n0.745894 0.254106 0.000001 Br\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Rb",
"Li",
"Dy",
"Br"
],
"chemical_system": "Br-Dy-Li-Rb",
"density": 4.229587517330993,
"density_atomic": 0.031069959444904614,
"volume": 321.85429844968695,
"volume_molar": 19.382518894750646,
"formula_full": "Rb2 Li1 Dy1 Br6",
"formula_reduced": "Rb2LiDyBr6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-32973",
"created_at": "2022-09-04T14:37:56.162455Z",
"updated_at": "2022-09-04T14:37:56.162472Z",
"structure_string": "Sn2 C4 S4 N4\n1.0\n4.759771 0.008281 -0.572490\n-0.438603 5.615151 -1.034724\n0.044410 0.034787 10.319198\nSn C S N\n2 4 4 4\ndirect\n0.817629 0.803915 0.255996 Sn\n0.182371 0.196086 0.744005 Sn\n0.795217 0.251334 0.002674 C\n0.204783 0.748666 0.997326 C\n0.809282 0.601760 0.626737 C\n0.190718 0.398240 0.373264 C\n0.615999 0.282494 0.127334 S\n0.736256 0.859393 0.593283 S\n0.263745 0.140607 0.406718 S\n0.384002 0.717506 0.872667 S\n0.147691 0.588779 0.349299 N\n0.916800 0.225155 0.908288 N\n0.083200 0.774845 0.091712 N\n0.852310 0.411221 0.650702 N\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Sn",
"C",
"S",
"N"
],
"chemical_system": "C-N-S-Sn",
"density": 2.8245917091373807,
"density_atomic": 0.05069535858032801,
"volume": 276.1594037808543,
"volume_molar": 11.879077155471292,
"formula_full": "Sn2 C4 S4 N4",
"formula_reduced": "SnC2(SN)2",
"formula_anonymous": "AB2C2D2",
"energy_above_hull": 4.344965457142857,
"spacegroup": 2
},
{
"id": "jvasp-29200",
"created_at": "2022-09-04T14:37:38.519978Z",
"updated_at": "2022-09-04T14:37:38.520002Z",
"structure_string": "Te2 Mo3 W1 Se6\n1.0\n3.384588 0.000000 0.000000\n-1.692294 2.931143 -0.000029\n0.000000 -0.000448 36.285284\nTe Mo W Se\n2 3 1 6\ndirect\n0.333348 0.666696 0.334936 Te\n0.333336 0.666671 0.231103 Te\n0.333287 0.666573 0.092374 Mo\n0.333341 0.666681 0.473627 Mo\n0.666677 0.333351 0.283019 Mo\n0.666699 0.333395 0.653894 W\n0.333372 0.666743 0.699653 Se\n0.666617 0.333230 0.046838 Se\n0.666673 0.333343 0.428010 Se\n0.666625 0.333249 0.138000 Se\n0.666677 0.333352 0.519209 Se\n0.333353 0.666705 0.608084 Se\n",
"nsites": 12,
"nelements": 4,
"elements": [
"Te",
"Mo",
"W",
"Se"
],
"chemical_system": "Mo-Se-Te-W",
"density": 5.538361856266759,
"density_atomic": 0.03333557131126851,
"volume": 359.9758314609598,
"volume_molar": 18.06520939379947,
"formula_full": "Te2 Mo3 W1 Se6",
"formula_reduced": "Te2Mo3WSe6",
"formula_anonymous": "AB2C3D6",
"energy_above_hull": 3.6260094527777778,
"spacegroup": 156
},
{
"id": "jvasp-45762",
"created_at": "2022-09-04T14:38:03.817760Z",
"updated_at": "2022-09-04T14:38:03.817787Z",
"structure_string": "Li4 V4 C4 O16\n1.0\n0.000000 3.100940 -0.011199\n9.305762 0.000000 0.000000\n0.000000 -0.209092 -9.197586\nLi V C O\n4 4 4 16\ndirect\n0.737760 0.186283 0.402436 Li\n0.737760 0.313717 0.902436 Li\n0.262240 0.686283 0.097565 Li\n0.262241 0.813717 0.597565 Li\n0.775437 0.562293 0.386893 V\n0.775438 0.937706 0.886893 V\n0.224563 0.062293 0.113107 V\n0.224563 0.437707 0.613108 V\n0.250900 0.129967 0.664785 C\n0.250900 0.370033 0.164785 C\n0.749101 0.629967 0.835216 C\n0.749101 0.870033 0.335215 C\n0.263953 0.006833 0.740722 O\n0.271989 0.616867 0.503645 O\n0.247266 0.126383 0.528955 O\n0.239679 0.249882 0.238411 O\n0.263953 0.493167 0.240722 O\n0.247265 0.373617 0.028955 O\n0.752735 0.626383 0.971046 O\n0.760321 0.749882 0.261589 O\n0.760322 0.750118 0.761590 O\n0.752735 0.873616 0.471046 O\n0.728012 0.383133 0.496356 O\n0.736048 0.993167 0.259279 O\n0.239679 0.250118 0.738411 O\n0.728012 0.116867 -0.003644 O\n0.736048 0.506833 0.759279 O\n0.271989 0.883133 0.003644 O\n",
"nsites": 28,
"nelements": 4,
"elements": [
"Li",
"V",
"C",
"O"
],
"chemical_system": "C-Li-O-V",
"density": 3.35046441095359,
"density_atomic": 0.10548803809353602,
"volume": 265.4329391847487,
"volume_molar": 5.70883757896813,
"formula_full": "Li4 V4 C4 O16",
"formula_reduced": "LiVCO4",
"formula_anonymous": "ABCD4",
"energy_above_hull": 3.091941171428572,
"spacegroup": 14
},
{
"id": "jvasp-110076",
"created_at": "2022-09-04T14:37:54.951557Z",
"updated_at": "2022-09-04T14:37:54.951582Z",
"structure_string": "Rb2 Na1 Pd1 F6\n1.0\n5.217612 0.003039 -3.189938\n-1.638870 4.953543 -3.189938\n-0.002194 -0.003039 6.115486\nRb Na Pd F\n2 1 1 6\ndirect\n0.750000 0.250000 0.500000 Rb\n0.250000 0.749999 0.500000 Rb\n0.500000 0.500000 -0.000001 Na\n0.000000 0.000000 0.000000 Pd\n0.234763 0.234763 0.469527 F\n0.765237 0.765236 0.530473 F\n0.234763 0.765236 -0.000001 F\n0.765236 0.234763 -0.000000 F\n0.247864 0.247864 -0.000000 F\n0.752135 0.752135 -0.000001 F\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Rb",
"Na",
"Pd",
"F"
],
"chemical_system": "F-Na-Pd-Rb",
"density": 4.35488847188481,
"density_atomic": 0.06329588732140286,
"volume": 157.98814777999965,
"volume_molar": 9.514268643428395,
"formula_full": "Rb2 Na1 Pd1 F6",
"formula_reduced": "Rb2NaPdF6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 139
},
{
"id": "jvasp-40698",
"created_at": "2022-09-04T14:37:54.862976Z",
"updated_at": "2022-09-04T14:37:54.863002Z",
"structure_string": "Li6 Mn5 Co1 O12\n1.0\n5.044339 -0.009975 0.198739\n-2.161245 -4.561866 -0.127897\n-1.482593 0.414646 -10.199827\nLi Mn Co O\n6 5 1 12\ndirect\n0.718158 0.976039 0.214454 Li\n0.056461 0.653042 0.219616 Li\n0.626907 0.698836 0.786365 Li\n0.281842 0.023960 0.785547 Li\n0.373092 0.301163 0.213636 Li\n0.943539 0.346957 0.780385 Li\n0.669337 0.332876 0.000194 Mn\n0.831447 0.668402 0.500012 Mn\n0.500000 -0.000001 0.500000 Mn\n0.330662 0.667123 0.999806 Mn\n0.168553 0.331597 0.499989 Mn\n0.000000 0.000000 0.000000 Co\n0.759379 0.962599 0.396003 O\n0.996654 0.296519 0.116863 O\n0.863968 0.332777 0.592909 O\n0.666381 0.042872 0.884444 O\n0.333619 0.957127 0.115557 O\n0.427453 0.293385 0.395851 O\n0.660449 0.620487 0.116877 O\n0.339551 0.379512 0.883123 O\n0.572547 0.706614 0.604150 O\n0.240621 0.037401 0.603997 O\n0.136032 0.667222 0.407092 O\n0.003345 0.703481 0.883137 O\n",
"nsites": 24,
"nelements": 4,
"elements": [
"Li",
"Mn",
"Co",
"O"
],
"chemical_system": "Co-Li-Mn-O",
"density": 4.031028780507332,
"density_atomic": 0.10270561391752277,
"volume": 233.67758669232123,
"volume_molar": 5.863497164659422,
"formula_full": "Li6 Mn5 Co1 O12",
"formula_reduced": "Li6Mn5CoO12",
"formula_anonymous": "AB5C6D12",
"energy_above_hull": 2.9806062127873565,
"spacegroup": 2
},
{
"id": "jvasp-39126",
"created_at": "2022-09-04T14:37:54.837230Z",
"updated_at": "2022-09-04T14:37:54.837255Z",
"structure_string": "Sc2 Al2 C2 O2\n1.0\n1.640476 0.947128 10.093025\n-1.640476 0.947128 10.093025\n0.000000 -1.894259 10.093025\nSc Al C O\n2 2 2 2\ndirect\n0.000000 0.000000 0.000000 Sc\n0.500001 0.500001 0.500000 Sc\n0.738711 0.738711 0.738709 Al\n0.261290 0.261290 0.261290 Al\n0.618382 0.618382 0.618381 C\n0.381619 0.381619 0.381618 C\n0.200001 0.200001 0.200001 O\n0.800000 0.800000 0.799997 O\n",
"nsites": 8,
"nelements": 4,
"elements": [
"Sc",
"Al",
"C",
"O"
],
"chemical_system": "Al-C-O-Sc",
"density": 3.527764890400728,
"density_atomic": 0.08502338123540117,
"volume": 94.09176492111845,
"volume_molar": 7.08292315889757,
"formula_full": "Sc2 Al2 C2 O2",
"formula_reduced": "ScAlCO",
"formula_anonymous": "ABCD",
"energy_above_hull": 2.7028453875,
"spacegroup": 166
},
{
"id": "jvasp-24242",
"created_at": "2022-09-04T14:37:54.798642Z",
"updated_at": "2022-09-04T14:37:54.798668Z",
"structure_string": "Er8 Ge8 Bi8 O40\n1.0\n5.352384 0.000000 0.000000\n0.000000 11.030700 0.000000\n0.000000 0.000000 15.357065\nEr Ge Bi O\n8 8 8 40\ndirect\n0.012171 0.858611 0.554098 Er\n0.512171 0.141389 0.945901 Er\n0.487828 0.358611 0.445901 Er\n0.487828 0.858611 0.054098 Er\n0.987828 0.141389 0.445901 Er\n0.512171 0.641389 0.554098 Er\n0.012171 0.358611 0.945901 Er\n0.987828 0.641389 0.054098 Er\n0.505390 0.097610 0.595230 Ge\n0.494609 0.402390 0.095231 Ge\n0.005390 0.902390 0.904769 Ge\n0.994609 0.097610 0.095231 Ge\n0.994609 0.597610 0.404769 Ge\n0.505390 0.597610 0.904769 Ge\n0.005390 0.402390 0.595230 Ge\n0.494609 0.902390 0.404769 Ge\n0.962671 0.644981 0.738198 Bi\n0.037328 0.855019 0.238198 Bi\n0.962671 0.144981 0.761802 Bi\n0.462671 0.355019 0.761802 Bi\n0.537328 0.144981 0.261802 Bi\n0.037328 0.355019 0.261802 Bi\n0.537328 0.644981 0.238198 Bi\n0.462671 0.855019 0.738198 Bi\n0.696058 0.024929 0.373860 O\n0.350598 0.193169 0.520579 O\n0.253034 0.734546 0.650455 O\n0.064034 0.330927 0.698658 O\n0.301813 0.959319 0.938924 O\n0.649401 0.306831 0.020580 O\n0.149401 0.193169 0.020580 O\n0.564034 0.669073 0.801342 O\n0.698187 0.540681 0.438925 O\n0.303941 0.975071 0.626140 O\n0.301813 0.459319 0.561075 O\n0.196059 0.475071 0.373860 O\n0.564034 0.169073 0.698658 O\n0.803941 0.524929 0.626140 O\n0.350598 0.693169 0.979420 O\n0.149401 0.693169 0.479420 O\n0.753034 0.265454 0.849545 O\n0.303941 0.475071 0.873860 O\n0.649401 0.806831 0.479420 O\n0.935965 0.169073 0.198658 O\n0.753034 0.765454 0.650455 O\n0.196059 0.975071 0.126140 O\n0.253034 0.234546 0.849545 O\n0.696058 0.524929 0.126140 O\n0.746965 0.765454 0.150455 O\n0.198187 0.959319 0.438925 O\n0.935965 0.669073 0.301342 O\n0.801812 0.040681 0.561075 O\n0.435966 0.830927 0.301342 O\n0.198187 0.459319 0.061075 O\n0.746965 0.265454 0.349545 O\n0.801812 0.540681 0.938924 O\n0.064034 0.830927 0.801342 O\n0.246966 0.234546 0.349545 O\n0.850598 0.306831 0.520579 O\n0.850598 0.806831 0.979420 O\n0.435966 0.330927 0.198658 O\n0.803941 0.024929 0.873860 O\n0.698187 0.040681 0.061075 O\n0.246966 0.734546 0.150455 O\n",
"nsites": 64,
"nelements": 4,
"elements": [
"Er",
"Ge",
"Bi",
"O"
],
"chemical_system": "Bi-Er-Ge-O",
"density": 7.7488046597355,
"density_atomic": 0.07058646201463677,
"volume": 906.6894440286438,
"volume_molar": 8.531580402416616,
"formula_full": "Er8 Ge8 Bi8 O40",
"formula_reduced": "ErGeBiO5",
"formula_anonymous": "ABCD5",
"energy_above_hull": 1.9022272187499996,
"spacegroup": 61
},
{
"id": "jvasp-32189",
"created_at": "2022-09-04T14:38:04.041757Z",
"updated_at": "2022-09-04T14:38:04.041780Z",
"structure_string": "Re2 H8 N2 O8\n1.0\n5.553421 0.000000 -2.410913\n-1.046653 5.453898 -2.410913\n-0.047029 -0.056912 7.493144\nRe H N O\n2 8 2 8\ndirect\n0.000000 0.000000 0.000000 Re\n0.250000 0.750001 0.500000 Re\n0.848193 0.169871 0.599592 H\n0.401807 0.580130 0.900409 H\n0.419871 0.501399 0.099592 H\n0.570280 0.151807 0.400409 H\n0.751399 0.429720 0.599592 H\n0.679720 0.598193 0.099592 H\n0.498602 0.320281 0.900409 H\n0.830129 0.248602 0.400409 H\n0.500000 0.500000 0.000001 N\n0.750000 0.250000 0.500000 N\n0.457987 0.033634 0.663113 O\n0.283635 0.955126 0.163114 O\n0.792013 0.716367 0.836887 O\n0.370521 0.542013 0.336887 O\n0.966366 0.794875 0.336888 O\n0.205126 0.629480 0.663114 O\n0.879479 0.207988 0.163114 O\n0.044874 0.120521 0.836887 O\n",
"nsites": 20,
"nelements": 4,
"elements": [
"Re",
"H",
"N",
"O"
],
"chemical_system": "H-N-O-Re",
"density": 3.9518642782635443,
"density_atomic": 0.08872059152748701,
"volume": 225.42681079627033,
"volume_molar": 6.787759928465139,
"formula_full": "Re2 H8 N2 O8",
"formula_reduced": "ReH4NO4",
"formula_anonymous": "ABC4D4",
"energy_above_hull": 3.724685525000001,
"spacegroup": 88
},
{
"id": "jvasp-58135",
"created_at": "2022-09-04T14:37:38.495155Z",
"updated_at": "2022-09-04T14:37:38.495188Z",
"structure_string": "Ba1 Ti4 Zn1 O8\n1.0\n2.703170 -4.682027 0.000000\n2.703170 4.682027 0.000000\n0.000000 -0.000000 7.446853\nBa Ti Zn O\n1 4 1 8\ndirect\n0.000000 0.000000 0.000000 Ba\n0.333333 0.666667 0.746223 Ti\n0.666667 0.333333 0.746223 Ti\n0.333333 0.666667 0.253776 Ti\n0.666667 0.333333 0.253776 Ti\n0.000000 0.000000 0.500000 Zn\n0.683182 -0.000000 0.674386 O\n-0.000000 0.683182 0.674386 O\n0.316819 0.316819 0.674386 O\n0.316819 -0.000000 0.325614 O\n0.683181 0.683181 0.325614 O\n-0.000000 0.316819 0.325614 O\n0.333333 0.666667 0.000000 O\n0.666667 0.333333 0.000000 O\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Ba",
"Ti",
"Zn",
"O"
],
"chemical_system": "Ba-O-Ti-Zn",
"density": 4.600184498377133,
"density_atomic": 0.07427078021773856,
"volume": 188.49943354514932,
"volume_molar": 8.108358014208248,
"formula_full": "Ba1 Ti4 Zn1 O8",
"formula_reduced": "BaTi4ZnO8",
"formula_anonymous": "ABC4D8",
"energy_above_hull": 2.7015612645238094,
"spacegroup": 162
},
{
"id": "jvasp-38069",
"created_at": "2022-09-04T14:37:54.776143Z",
"updated_at": "2022-09-04T14:37:54.776161Z",
"structure_string": "Rb2 Tl1 In1 F6\n1.0\n0.000000 4.696658 4.696658\n4.696658 0.000000 4.696658\n4.696658 4.696658 -0.000000\nRb Tl In F\n2 1 1 6\ndirect\n0.250000 0.250000 0.250000 Rb\n0.750000 0.750000 0.750000 Rb\n0.000000 0.000000 0.000000 Tl\n0.500000 0.500000 0.500000 In\n0.276875 0.723125 0.723125 F\n0.276875 0.723125 0.276875 F\n0.723125 0.276875 0.723125 F\n0.723125 0.723125 0.276875 F\n0.276875 0.276875 0.723125 F\n0.723125 0.276875 0.276875 F\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Rb",
"Tl",
"In",
"F"
],
"chemical_system": "F-In-Rb-Tl",
"density": 4.841509252868868,
"density_atomic": 0.04826176419285913,
"volume": 207.20336621013146,
"volume_molar": 12.478078372632396,
"formula_full": "Rb2 Tl1 In1 F6",
"formula_reduced": "Rb2TlInF6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-29435",
"created_at": "2022-09-04T14:38:04.713138Z",
"updated_at": "2022-09-04T14:38:04.713156Z",
"structure_string": "K4 Na4 Zn4 O8\n1.0\n5.601417 0.029949 0.000000\n-1.373935 5.674032 0.000000\n0.000000 0.000000 9.599563\nK Na Zn O\n4 4 4 8\ndirect\n0.500011 0.750056 0.377603 K\n0.000010 0.750056 0.122397 K\n-0.000011 0.249944 0.877603 K\n0.499989 0.249944 0.622397 K\n0.999960 0.749958 0.477352 Na\n0.499960 0.749958 0.022648 Na\n0.500040 0.250042 0.977351 Na\n0.000040 0.250042 0.522648 Na\n0.000127 0.750014 0.760397 Zn\n0.499872 0.249985 0.260398 Zn\n0.500127 0.750014 0.739602 Zn\n0.999873 0.249985 0.239602 Zn\n0.295663 0.431686 0.141250 O\n0.704099 0.068234 0.141281 O\n0.204336 0.568314 0.641250 O\n0.295901 0.931766 0.858719 O\n0.704337 0.568314 0.858750 O\n0.795663 0.431686 0.358750 O\n0.795901 0.931766 0.641280 O\n0.204099 0.068234 0.358719 O\n",
"nsites": 20,
"nelements": 4,
"elements": [
"K",
"Na",
"Zn",
"O"
],
"chemical_system": "K-Na-O-Zn",
"density": 3.4678114453713547,
"density_atomic": 0.06546767873881545,
"volume": 305.4942589272239,
"volume_molar": 9.198647143158144,
"formula_full": "K4 Na4 Zn4 O8",
"formula_reduced": "KNaZnO2",
"formula_anonymous": "ABCD2",
"energy_above_hull": 0.03302288,
"spacegroup": 15
}
]
}