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=3799",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-density&page=3797",
"results": [
{
"id": "jvasp-42268",
"created_at": "2022-09-04T14:36:18.426890Z",
"updated_at": "2022-09-04T14:36:18.426904Z",
"structure_string": "Li4 Mn4 Si4 O16\n1.0\n4.778685 0.000000 0.000000\n0.000000 6.201839 0.000000\n0.000000 0.000000 9.991484\nLi Mn Si O\n4 4 4 16\ndirect\n0.056126 0.006586 0.219081 Li\n0.443873 0.006586 0.719081 Li\n0.556126 0.506586 0.280919 Li\n0.943873 0.506586 0.780919 Li\n0.000002 0.256522 0.499996 Mn\n0.499997 0.256522 -0.000004 Mn\n0.500002 0.756522 0.000004 Mn\n-0.000002 0.756522 0.500004 Mn\n0.906305 0.006521 0.905884 Si\n0.593694 0.006521 0.405884 Si\n0.406305 0.506521 0.594115 Si\n0.093694 0.506521 0.094116 Si\n0.754978 0.229428 0.850288 O\n0.742905 0.506520 0.594594 O\n0.757094 0.506520 0.094594 O\n0.745021 0.229428 0.350288 O\n0.745004 0.783600 0.350304 O\n0.759655 0.006526 0.558870 O\n0.240344 0.506526 0.441129 O\n0.245004 0.283599 0.149696 O\n0.254978 0.729428 0.649711 O\n0.242905 0.006519 0.905406 O\n0.257094 0.006519 0.405406 O\n0.245021 0.729428 0.149712 O\n0.754995 0.783600 0.850304 O\n0.259655 0.506526 0.941129 O\n0.254995 0.283599 0.649696 O\n0.740344 0.006526 0.058871 O\n",
"nsites": 28,
"nelements": 4,
"elements": [
"Li",
"Mn",
"Si",
"O"
],
"chemical_system": "Li-Mn-O-Si",
"density": 3.453537316811955,
"density_atomic": 0.0945581882758199,
"volume": 296.11396443347536,
"volume_molar": 6.368714195785794,
"formula_full": "Li4 Mn4 Si4 O16",
"formula_reduced": "LiMnSiO4",
"formula_anonymous": "ABCD4",
"energy_above_hull": 2.5528185487684727,
"spacegroup": 62
},
{
"id": "jvasp-22716",
"created_at": "2022-09-04T14:36:43.402582Z",
"updated_at": "2022-09-04T14:36:43.402610Z",
"structure_string": "K2 Ge1 F6\n1.0\n5.643396 0.000000 -0.000000\n-2.821698 4.887324 -0.000000\n0.000000 -0.000000 4.617070\nK Ge F\n2 1 6\ndirect\n0.333333 0.666666 0.701367 K\n0.666667 0.333333 0.298632 K\n0.000000 0.000000 0.000000 Ge\n0.844057 0.155943 0.777759 F\n0.844057 0.688112 0.777759 F\n0.311888 0.155943 0.777759 F\n0.155943 0.844056 0.222241 F\n0.155943 0.311887 0.222241 F\n0.688112 0.844056 0.222241 F\n",
"nsites": 9,
"nelements": 3,
"elements": [
"K",
"Ge",
"F"
],
"chemical_system": "F-Ge-K",
"density": 3.4532917704702295,
"density_atomic": 0.07067476829749875,
"volume": 127.34389113403742,
"volume_molar": 8.520920414836548,
"formula_full": "K2 Ge1 F6",
"formula_reduced": "K2GeF6",
"formula_anonymous": "AB2C6",
"energy_above_hull": 0.0,
"spacegroup": 164
},
{
"id": "jvasp-11593",
"created_at": "2022-09-04T14:37:18.465237Z",
"updated_at": "2022-09-04T14:37:18.465263Z",
"structure_string": "Ca1 V4 O10\n1.0\n3.621500 0.000000 0.000000\n0.000000 4.695663 0.000000\n0.000000 0.000000 11.420194\nCa V O\n1 4 10\ndirect\n0.000000 0.838773 0.000000 Ca\n0.000000 0.617778 0.348507 V\n0.500000 0.376534 0.155383 V\n0.500000 0.376534 0.844617 V\n0.000000 0.617778 0.651493 V\n0.500000 0.517948 0.000000 O\n0.000000 0.526883 0.500000 O\n0.500000 0.496195 0.316566 O\n0.000000 0.504897 0.170938 O\n0.500000 0.496195 0.683433 O\n0.000000 0.504897 0.829061 O\n0.000000 0.961278 0.656153 O\n0.500000 0.027175 0.872424 O\n0.500000 0.027175 0.127575 O\n0.000000 0.961278 0.343846 O\n",
"nsites": 15,
"nelements": 3,
"elements": [
"Ca",
"V",
"O"
],
"chemical_system": "Ca-O-V",
"density": 3.453006437704997,
"density_atomic": 0.07723823966627137,
"volume": 194.2043224290396,
"volume_molar": 7.796838439120677,
"formula_full": "Ca1 V4 O10",
"formula_reduced": "CaV4O10",
"formula_anonymous": "AB4C10",
"energy_above_hull": 3.2285854813333343,
"spacegroup": 25
},
{
"id": "jvasp-79276",
"created_at": "2022-09-04T14:37:14.102224Z",
"updated_at": "2022-09-04T14:37:14.102233Z",
"structure_string": "B2 N2\n1.0\n2.487326 -0.000000 -0.000000\n-1.243662 2.154087 0.000000\n0.000000 0.000000 4.455116\nB N\n2 2\ndirect\n0.666669 0.333333 0.749999 B\n0.333335 0.666668 0.250002 B\n0.000000 0.000000 0.000000 N\n0.000000 0.000000 0.500000 N\n",
"nsites": 4,
"nelements": 2,
"elements": [
"B",
"N"
],
"chemical_system": "B-N",
"density": 3.4529131737131005,
"density_atomic": 0.16757337844638753,
"volume": 23.870139977393467,
"volume_molar": 3.593733572619167,
"formula_full": "B2 N2",
"formula_reduced": "BN",
"formula_anonymous": "AB",
"energy_above_hull": 3.8149229166666663,
"spacegroup": 194
},
{
"id": "jvasp-34788",
"created_at": "2022-09-04T14:37:13.881855Z",
"updated_at": "2022-09-04T14:37:13.881874Z",
"structure_string": "Al2 H2 O4\n1.0\n2.859196 0.000000 0.000000\n0.000000 4.247368 0.000000\n0.000000 0.000000 4.751123\nAl H O\n2 2 4\ndirect\n0.500001 0.273706 0.492043 Al\n0.000000 0.726295 0.992043 Al\n0.500001 0.200011 0.976589 H\n0.000000 0.799990 0.476589 H\n0.000000 0.502501 0.649225 O\n0.500001 0.497500 0.149225 O\n0.000000 -0.001566 0.347552 O\n0.500001 0.001566 0.847551 O\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Al",
"H",
"O"
],
"chemical_system": "Al-H-O",
"density": 3.4529111299996864,
"density_atomic": 0.13865319925225994,
"volume": 57.697911358288444,
"volume_molar": 4.343311796970198,
"formula_full": "Al2 H2 O4",
"formula_reduced": "AlHO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.65109245,
"spacegroup": 31
},
{
"id": "jvasp-112164",
"created_at": "2022-09-04T14:38:44.946490Z",
"updated_at": "2022-09-04T14:38:44.946512Z",
"structure_string": "Cd1 H2 C3 O4\n1.0\n3.547378 0.002873 1.018576\n1.509407 4.428333 1.417425\n0.032258 -0.013523 6.573440\nCd H C O\n1 2 3 4\ndirect\n0.244754 0.500058 0.535326 Cd\n0.199037 0.205324 0.994156 H\n0.363155 0.794787 0.076481 H\n0.784853 0.966482 0.838048 C\n0.554005 0.033630 0.232602 C\n0.444938 0.000055 0.035322 C\n0.518646 0.296505 0.242455 O\n0.665000 0.796570 0.380039 O\n0.806237 0.203540 0.690624 O\n0.022203 0.703601 0.828196 O\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Cd",
"H",
"C",
"O"
],
"chemical_system": "C-Cd-H-O",
"density": 3.4528770258811,
"density_atomic": 0.09696000693479309,
"volume": 103.13530615488853,
"volume_molar": 6.210953309904331,
"formula_full": "Cd1 H2 C3 O4",
"formula_reduced": "CdH2C3O4",
"formula_anonymous": "AB2C3D4",
"energy_above_hull": 3.624894375,
"spacegroup": 5
},
{
"id": "jvasp-113173",
"created_at": "2022-09-04T14:38:44.912687Z",
"updated_at": "2022-09-04T14:38:44.912707Z",
"structure_string": "Li4 Mn4 P4 O16\n1.0\n5.250452 -0.080429 -0.000000\n0.748302 9.388261 -0.000001\n-0.000000 -0.000001 6.114365\nLi Mn P O\n4 4 4 16\ndirect\n0.169206 0.927938 0.640924 Li\n0.330792 0.572062 0.140924 Li\n0.669206 0.427938 0.859077 Li\n0.830792 0.072062 0.359076 Li\n0.222868 0.330518 0.609004 Mn\n0.277130 0.169482 0.109003 Mn\n0.722868 0.830518 0.890997 Mn\n0.777130 0.669482 0.390998 Mn\n0.260568 0.633432 0.651749 P\n0.239431 0.866568 0.151748 P\n0.760567 0.133432 0.848252 P\n0.739432 0.366568 0.348253 P\n0.485832 0.763560 0.165415 O\n0.492284 0.729192 0.646418 O\n0.507717 0.270808 0.353583 O\n0.785194 0.023355 0.660205 O\n0.261779 0.953305 0.938249 O\n0.214805 0.976644 0.339795 O\n0.285194 0.523355 0.839795 O\n0.992283 0.229192 0.853583 O\n0.985831 0.263560 0.334586 O\n0.014169 0.736440 0.665415 O\n0.714805 0.476644 0.160205 O\n0.761779 0.453305 0.561751 O\n0.738219 0.046695 0.061751 O\n0.007716 0.770808 0.146417 O\n0.238219 0.546695 0.438249 O\n0.514169 0.236440 0.834587 O\n",
"nsites": 28,
"nelements": 4,
"elements": [
"Li",
"Mn",
"P",
"O"
],
"chemical_system": "Li-Mn-O-P",
"density": 3.4524833314741263,
"density_atomic": 0.0927886557579234,
"volume": 301.761026402293,
"volume_molar": 6.490169203131017,
"formula_full": "Li4 Mn4 P4 O16",
"formula_reduced": "LiMnPO4",
"formula_anonymous": "ABCD4",
"energy_above_hull": 2.546420963054187,
"spacegroup": 14
},
{
"id": "jvasp-44027",
"created_at": "2022-09-04T14:36:17.933096Z",
"updated_at": "2022-09-04T14:36:17.933115Z",
"structure_string": "Li4 Mn4 F16\n1.0\n0.000000 5.762892 0.100605\n4.624870 0.000000 0.000000\n0.000000 -0.173358 -9.955233\nLi Mn F\n4 4 16\ndirect\n0.500008 0.249996 0.000002 Li\n0.499996 0.249997 0.500003 Li\n0.000009 0.750004 0.000002 Li\n-0.000004 0.750003 0.500002 Li\n0.208394 0.249351 0.749337 Mn\n0.791609 0.250649 0.250671 Mn\n0.708394 0.750649 0.749337 Mn\n0.291609 0.749351 0.250670 Mn\n0.448844 0.481056 0.829344 F\n0.510764 0.495399 0.331235 F\n0.010764 0.504601 0.331235 F\n0.948844 0.518944 0.829344 F\n0.279944 0.540926 0.092034 F\n0.726036 0.545176 0.590713 F\n0.273961 0.954829 0.409296 F\n0.551159 0.018942 0.170662 F\n0.051159 0.981058 0.170662 F\n0.989237 -0.004600 0.668774 F\n0.226036 0.454825 0.590713 F\n0.489238 0.004600 0.668773 F\n0.220063 0.040925 0.907971 F\n0.773961 0.045171 0.409296 F\n0.720063 0.959075 0.907972 F\n0.779944 0.459074 0.092034 F\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Li",
"Mn",
"F"
],
"chemical_system": "F-Li-Mn",
"density": 3.452453532032879,
"density_atomic": 0.09047984484903204,
"volume": 265.2524442326865,
"volume_molar": 6.655781483763701,
"formula_full": "Li4 Mn4 F16",
"formula_reduced": "LiMnF4",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.3435997285632184,
"spacegroup": 14
},
{
"id": "jvasp-7814",
"created_at": "2022-09-04T14:37:05.259572Z",
"updated_at": "2022-09-04T14:37:05.259592Z",
"structure_string": "Mg2 C2 N4\n1.0\n4.043048 -0.000000 -1.930688\n-0.921967 3.936523 -1.930688\n-0.393342 -0.496110 4.374914\nMg C N\n2 2 4\ndirect\n0.249999 0.749999 0.499998 Mg\n0.000000 0.000000 0.000000 Mg\n0.500000 0.499999 -0.000001 C\n0.750000 0.250000 0.499999 C\n0.773335 0.874999 0.249998 N\n0.625000 0.226664 0.749999 N\n0.476664 0.375000 0.249999 N\n0.125000 0.523335 0.749999 N\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Mg",
"C",
"N"
],
"chemical_system": "C-Mg-N",
"density": 3.4522954486071904,
"density_atomic": 0.12927405571540407,
"volume": 61.88403354198111,
"volume_molar": 4.658429509829645,
"formula_full": "Mg2 C2 N4",
"formula_reduced": "MgCN2",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.8105813875,
"spacegroup": 122
},
{
"id": "jvasp-115197",
"created_at": "2022-09-04T14:38:45.256753Z",
"updated_at": "2022-09-04T14:38:45.256786Z",
"structure_string": "Li2 I2\n1.0\n4.516823 -0.187116 -0.323268\n-2.379579 -3.775210 0.003035\n1.717605 -3.442548 -7.627345\nLi I\n2 2\ndirect\n0.072502 -0.004736 0.055908 Li\n0.905578 0.161172 0.555917 Li\n0.443703 0.372383 0.680008 I\n0.288027 0.547746 0.180032 I\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Li",
"I"
],
"chemical_system": "I-Li",
"density": 3.452268792215537,
"density_atomic": 0.031065748605853826,
"volume": 128.75916980948807,
"volume_molar": 19.385146118336987,
"formula_full": "Li2 I2",
"formula_reduced": "LiI",
"formula_anonymous": "AB",
"energy_above_hull": 0.0,
"spacegroup": 186
},
{
"id": "jvasp-38100",
"created_at": "2022-09-04T14:38:00.627296Z",
"updated_at": "2022-09-04T14:38:00.627320Z",
"structure_string": "Rb2 Na1 Tl1 Cl6\n1.0\n0.000000 5.277059 5.277059\n5.277059 -0.000000 5.277059\n5.277059 5.277059 -0.000000\nRb Na Tl Cl\n2 1 1 6\ndirect\n0.250000 0.250000 0.250000 Rb\n0.750000 0.750000 0.750000 Rb\n0.500000 0.500000 0.500000 Na\n0.000000 0.000000 0.000000 Tl\n0.246401 0.753599 0.753599 Cl\n0.246401 0.753599 0.246401 Cl\n0.753599 0.246401 0.753599 Cl\n0.753599 0.753599 0.246401 Cl\n0.246401 0.246401 0.753599 Cl\n0.753599 0.246401 0.246401 Cl\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Rb",
"Na",
"Tl",
"Cl"
],
"chemical_system": "Cl-Na-Rb-Tl",
"density": 3.452259381679963,
"density_atomic": 0.0340246882647359,
"volume": 293.90423571828194,
"volume_molar": 17.699326774557136,
"formula_full": "Rb2 Na1 Tl1 Cl6",
"formula_reduced": "Rb2NaTlCl6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-79204",
"created_at": "2022-09-04T14:37:11.766527Z",
"updated_at": "2022-09-04T14:37:11.766542Z",
"structure_string": "B2 N2\n1.0\n-1.277109 -2.212017 0.000000\n-1.277109 2.212017 0.000000\n0.000000 0.000000 -4.225650\nB N\n2 2\ndirect\n0.333334 0.666667 0.499769 B\n0.666667 0.333334 0.999769 B\n0.333333 0.666668 0.125231 N\n0.666668 0.333333 0.625231 N\n",
"nsites": 4,
"nelements": 2,
"elements": [
"B",
"N"
],
"chemical_system": "B-N",
"density": 3.452237608649316,
"density_atomic": 0.16754059258864845,
"volume": 23.87481110217236,
"volume_molar": 3.5944368268923177,
"formula_full": "B2 N2",
"formula_reduced": "BN",
"formula_anonymous": "AB",
"energy_above_hull": 2.5462079166666665,
"spacegroup": 186
}
]
}