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_atomic&page=4393",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=density_atomic&page=4391",
"results": [
{
"id": "jvasp-116846",
"created_at": "2022-09-04T14:38:45.676332Z",
"updated_at": "2022-09-04T14:38:45.676358Z",
"structure_string": "Li4 Mn4 Cr2 O12\n1.0\n4.924575 -0.051879 0.000000\n-2.399163 4.300947 0.000000\n-0.000000 -0.000000 9.997252\nLi Mn Cr O\n4 4 2 12\ndirect\n0.660677 0.160678 0.750000 Li\n0.839322 0.339322 0.250000 Li\n0.160678 0.660678 0.750000 Li\n0.339322 0.839323 0.250000 Li\n0.837303 0.162696 0.500000 Mn\n0.662696 0.337304 -0.000000 Mn\n0.337304 0.662696 -0.000000 Mn\n0.162697 0.837305 0.500000 Mn\n0.000000 0.000000 0.000000 Cr\n0.500000 0.500000 0.500000 Cr\n0.160239 0.504299 0.393131 O\n0.837825 0.837825 0.396356 O\n0.995700 0.339762 0.893130 O\n0.662175 0.662175 0.896356 O\n0.337825 0.337825 0.103644 O\n0.660238 0.004299 0.106869 O\n0.839761 0.495701 0.606869 O\n0.504299 0.160238 0.393131 O\n0.339762 0.995702 0.893130 O\n0.495701 0.839762 0.606869 O\n0.162175 0.162175 0.603643 O\n0.004300 0.660239 0.106869 O\n",
"nsites": 22,
"nelements": 4,
"elements": [
"Li",
"Mn",
"Cr",
"O"
],
"chemical_system": "Cr-Li-Mn-O",
"density": 4.287417348007385,
"density_atomic": 0.10451264835538324,
"volume": 210.50083742200783,
"volume_molar": 5.762116695696394,
"formula_full": "Li4 Mn4 Cr2 O12",
"formula_reduced": "Li2Mn2CrO6",
"formula_anonymous": "AB2C2D6",
"energy_above_hull": 3.0172057166144195,
"spacegroup": 64
},
{
"id": "jvasp-48359",
"created_at": "2022-09-04T14:36:55.759309Z",
"updated_at": "2022-09-04T14:36:55.759328Z",
"structure_string": "Co6 O7 F5\n1.0\n-4.545558 4.545558 2.921941\n-0.138551 4.426199 -2.951231\n-4.426199 0.138551 -2.951231\nCo O F\n6 7 5\ndirect\n0.842009 0.678579 0.690547 Co\n0.316918 0.660283 0.666743 Co\n0.683082 0.333257 0.339717 Co\n0.157991 0.309453 0.321421 Co\n0.500000 0.997334 0.002666 Co\n0.000000 0.023780 0.976219 Co\n0.000000 0.315563 0.684437 O\n0.670656 0.634887 0.038546 O\n0.329344 0.961454 0.365113 O\n0.965443 0.226550 0.221782 O\n0.669824 0.033526 0.644902 O\n0.330176 0.355098 0.966474 O\n0.034558 0.778218 0.773449 O\n0.692076 0.093228 0.104157 F\n0.630876 0.579737 0.579255 F\n0.307925 0.895843 0.906772 F\n0.369124 0.420745 0.420263 F\n0.000000 0.702464 0.297537 F\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Co",
"O",
"F"
],
"chemical_system": "Co-F-O",
"density": 5.404975268502646,
"density_atomic": 0.10451391283008175,
"volume": 172.22587416915792,
"volume_molar": 5.762046982003983,
"formula_full": "Co6 O7 F5",
"formula_reduced": "Co6O7F5",
"formula_anonymous": "A5B6C7",
"energy_above_hull": 2.4251206284722224,
"spacegroup": 5
},
{
"id": "jvasp-85202",
"created_at": "2022-09-04T14:36:52.553166Z",
"updated_at": "2022-09-04T14:36:52.553186Z",
"structure_string": "Re2 N4\n1.0\n3.871349 0.000000 1.742926\n0.000000 2.961799 0.000000\n0.002431 0.000000 5.007688\nRe N\n2 4\ndirect\n0.500000 0.811070 0.750001 Re\n0.500000 0.188930 0.250000 Re\n0.176625 0.302679 0.691629 N\n0.823375 0.302679 0.808372 N\n0.823375 0.697322 0.308372 N\n0.176625 0.697322 0.191629 N\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Re",
"N"
],
"chemical_system": "N-Re",
"density": 12.39309212574889,
"density_atomic": 0.1045179804426175,
"volume": 57.40639050420729,
"volume_molar": 5.761822735664396,
"formula_full": "Re2 N4",
"formula_reduced": "ReN2",
"formula_anonymous": "AB2",
"energy_above_hull": 5.166004833333332,
"spacegroup": 13
},
{
"id": "jvasp-112091",
"created_at": "2022-09-04T14:38:44.595195Z",
"updated_at": "2022-09-04T14:38:44.595223Z",
"structure_string": "H16 C22 S2 O2\n1.0\n4.131912 -0.111345 -0.538587\n-2.685980 8.366285 -1.823679\n-0.005328 -0.314108 11.808749\nH C S O\n16 22 2 2\ndirect\n0.818043 0.889858 0.007918 H\n0.436688 0.657987 0.396482 H\n0.936946 0.658061 0.896510 H\n0.922252 0.732541 0.324525 H\n0.530955 0.491761 0.710532 H\n0.030716 0.491691 0.210509 H\n0.461098 0.080852 0.708450 H\n-0.039076 0.080825 0.208425 H\n0.422528 0.732626 0.824542 H\n-0.001890 0.469896 0.798907 H\n0.624383 0.216154 0.199832 H\n0.124646 0.216234 0.699845 H\n0.016989 0.960764 0.669999 H\n0.516851 0.960694 0.170022 H\n0.317821 0.889797 0.507884 H\n0.497852 0.469822 0.298886 H\n0.487830 0.579440 0.665214 C\n0.856703 0.827459 0.174518 C\n0.356724 0.827471 0.674509 C\n0.991924 0.552540 0.043657 C\n0.933199 0.670218 0.989836 C\n0.866286 0.802735 0.053279 C\n0.366166 0.802703 0.553257 C\n0.433064 0.670181 0.489818 C\n0.987697 0.579400 0.165206 C\n0.491912 0.552538 0.543657 C\n0.423076 0.715595 0.730273 C\n0.050445 0.413762 0.968150 C\n0.268865 0.976388 0.722720 C\n0.768770 0.976358 0.222723 C\n0.672834 0.160784 0.371235 C\n0.172883 0.160798 0.871229 C\n0.550402 0.413747 0.468150 C\n0.547336 0.388424 0.348623 C\n0.047504 0.388477 0.848635 C\n0.616306 0.248053 0.293255 C\n0.116479 0.248105 0.793264 C\n0.922924 0.715546 0.230267 C\n0.139499 0.254025 0.014299 S\n0.639572 0.254043 0.514312 S\n0.250606 0.020626 0.847482 O\n0.750613 0.020619 0.347494 O\n",
"nsites": 42,
"nelements": 4,
"elements": [
"H",
"C",
"S",
"O"
],
"chemical_system": "C-H-O-S",
"density": 1.5558060356936843,
"density_atomic": 0.1045203292667836,
"volume": 401.8357031080224,
"volume_molar": 5.761693253595429,
"formula_full": "H16 C22 S2 O2",
"formula_reduced": "H8C11SO",
"formula_anonymous": "ABC8D11",
"energy_above_hull": 5.507300642857143,
"spacegroup": 1
},
{
"id": "jvasp-112102",
"created_at": "2022-09-04T14:38:44.210540Z",
"updated_at": "2022-09-04T14:38:44.210563Z",
"structure_string": "H2 C2 N2 O6\n1.0\n4.453474 -0.000213 0.002300\n0.000959 4.670905 1.146052\n-0.001197 0.001383 5.519563\nH C N O\n2 2 2 6\ndirect\n0.601462 0.539579 0.286125 H\n0.601460 0.039581 0.786124 H\n0.101439 0.727404 0.259792 C\n0.101437 0.227405 0.759792 C\n0.601463 0.748519 0.174632 N\n0.601461 0.248521 0.674631 N\n0.101528 0.480497 0.242483 O\n0.101526 0.980495 0.742483 O\n0.853911 0.389888 0.769164 O\n0.853913 0.889887 0.269164 O\n0.348848 0.889912 0.269107 O\n0.348846 0.389913 0.769106 O\n",
"nsites": 12,
"nelements": 4,
"elements": [
"H",
"C",
"N",
"O"
],
"chemical_system": "C-H-N-O",
"density": 2.1701944165328313,
"density_atomic": 0.10452092442539948,
"volume": 114.80954714062878,
"volume_molar": 5.761660445606017,
"formula_full": "H2 C2 N2 O6",
"formula_reduced": "HCNO3",
"formula_anonymous": "ABCD3",
"energy_above_hull": 3.817775625,
"spacegroup": 6
},
{
"id": "jvasp-44761",
"created_at": "2022-09-04T14:38:04.578971Z",
"updated_at": "2022-09-04T14:38:04.578984Z",
"structure_string": "Li12 Ni4 O12\n1.0\n8.595241 -0.000000 0.000000\n-0.000000 8.595241 0.000000\n0.000000 0.000000 3.626058\nLi Ni O\n12 4 12\ndirect\n0.365259 0.104304 0.500000 Li\n0.604304 0.134741 0.000000 Li\n0.163785 0.163785 0.000000 Li\n0.663784 0.336215 0.500000 Li\n0.104304 0.365259 0.500000 Li\n0.865259 0.395696 0.000000 Li\n0.134741 0.604304 0.000000 Li\n0.895696 0.634741 0.500000 Li\n0.336215 0.663784 0.500000 Li\n0.836215 0.836215 0.000000 Li\n0.395696 0.865259 0.000000 Li\n0.634741 0.895696 0.500000 Li\n0.115721 0.884279 0.500000 Ni\n0.615721 0.615721 0.000000 Ni\n0.384279 0.384279 0.000000 Ni\n0.884279 0.115721 0.500000 Ni\n0.100636 0.100636 0.500000 O\n0.672529 0.112924 0.500000 O\n0.387076 0.172529 0.000000 O\n0.887076 0.327471 0.500000 O\n0.172529 0.387076 0.000000 O\n0.600636 0.399364 0.000000 O\n0.399364 0.600636 0.000000 O\n0.827471 0.612923 0.000000 O\n0.112924 0.672529 0.500000 O\n0.612923 0.827471 0.000000 O\n0.327471 0.887076 0.500000 O\n0.899364 0.899364 0.500000 O\n",
"nsites": 28,
"nelements": 3,
"elements": [
"Li",
"Ni",
"O"
],
"chemical_system": "Li-Ni-O",
"density": 3.161681649916952,
"density_atomic": 0.10452186932698014,
"volume": 267.88652155087686,
"volume_molar": 5.761608358879122,
"formula_full": "Li12 Ni4 O12",
"formula_reduced": "Li3NiO3",
"formula_anonymous": "AB3C3",
"energy_above_hull": 1.4409432714285717,
"spacegroup": 136
},
{
"id": "jvasp-46841",
"created_at": "2022-09-04T14:38:14.818998Z",
"updated_at": "2022-09-04T14:38:14.819018Z",
"structure_string": "Li4 Fe2 P4 H2 O16\n1.0\n0.000000 4.782875 -0.023690\n7.845485 0.000000 0.000000\n0.000000 -1.802014 -7.130143\nLi Fe P H O\n4 2 4 2 16\ndirect\n0.371513 0.632389 0.909631 Li\n0.628489 0.132389 0.090368 Li\n0.862086 0.866267 0.408608 Li\n0.137916 0.366267 0.591392 Li\n0.250601 -0.000631 0.747139 Fe\n0.749401 0.499369 0.252860 Fe\n0.880348 0.842654 0.006161 P\n0.119654 0.342654 0.993839 P\n0.379565 0.653787 0.511843 P\n0.620437 0.153787 0.488157 P\n0.774021 0.491261 0.761114 H\n0.225981 0.991261 0.238886 H\n0.891763 0.320565 0.109705 O\n0.108238 0.820565 0.890295 O\n-0.009243 0.439548 0.805144 O\n0.872304 0.041827 0.596247 O\n0.733014 0.330737 0.446336 O\n0.009244 0.939548 0.194855 O\n0.604700 0.676629 0.391585 O\n0.266988 0.830737 0.553663 O\n0.770791 0.669504 0.057817 O\n0.629828 0.956290 0.903885 O\n0.504851 0.559268 0.697019 O\n0.395301 0.176629 0.608415 O\n0.229210 0.169504 0.942182 O\n0.370174 0.456290 0.096115 O\n0.495150 0.059268 0.302980 O\n0.127698 0.541827 0.403753 O\n",
"nsites": 28,
"nelements": 5,
"elements": [
"Li",
"Fe",
"P",
"H",
"O"
],
"chemical_system": "Fe-H-Li-O-P",
"density": 3.2317111403875733,
"density_atomic": 0.10452198599462495,
"volume": 267.88622253541854,
"volume_molar": 5.761601927760624,
"formula_full": "Li4 Fe2 P4 H2 O16",
"formula_reduced": "Li2FeP2HO8",
"formula_anonymous": "ABC2D2E8",
"energy_above_hull": 2.735265321428571,
"spacegroup": 4
},
{
"id": "jvasp-40709",
"created_at": "2022-09-04T14:37:19.908396Z",
"updated_at": "2022-09-04T14:37:19.908413Z",
"structure_string": "Li6 Ni4 O2 F10\n1.0\n5.068196 -0.011018 -0.003459\n-1.702119 4.773663 -0.003842\n-1.675697 -2.370418 8.710020\nLi Ni O F\n6 4 2 10\ndirect\n0.862306 0.112310 0.724967 Li\n0.458347 0.208435 0.916587 Li\n0.220952 0.470956 0.441702 Li\n0.791762 0.541523 0.583336 Li\n0.124948 0.875009 0.250080 Li\n0.541660 0.791726 0.083332 Li\n0.964462 0.714439 0.928816 Ni\n0.291627 0.041676 0.583333 Ni\n0.618920 0.368912 0.237849 Ni\n0.041704 0.291673 0.083333 Ni\n0.280977 0.052396 0.083332 O\n0.802425 0.530951 0.083333 O\n0.102060 0.887196 0.748998 F\n0.708059 0.959192 0.919511 F\n0.211713 0.460554 0.919563 F\n0.446110 0.231244 0.417665 F\n0.049303 0.283965 0.583334 F\n0.646895 0.361775 0.748991 F\n0.971525 0.686402 0.417680 F\n0.533924 0.799344 0.583335 F\n0.374173 0.625312 0.247154 F\n0.872810 0.121663 0.247105 F\n",
"nsites": 22,
"nelements": 4,
"elements": [
"Li",
"Ni",
"O",
"F"
],
"chemical_system": "F-Li-Ni-O",
"density": 3.932085487181432,
"density_atomic": 0.10452408675877892,
"volume": 210.4778016455832,
"volume_molar": 5.761486128932099,
"formula_full": "Li6 Ni4 O2 F10",
"formula_reduced": "Li3Ni2OF5",
"formula_anonymous": "AB2C3D5",
"energy_above_hull": 0.4395899738636365,
"spacegroup": 22
},
{
"id": "jvasp-113693",
"created_at": "2022-09-04T14:38:49.601066Z",
"updated_at": "2022-09-04T14:38:49.601091Z",
"structure_string": "Sc1 Al1 O3\n1.0\n3.630069 0.000000 0.000000\n-0.000000 3.630069 -0.000000\n0.000000 -0.000000 3.630069\nSc Al O\n1 1 3\ndirect\n0.000000 0.000000 0.000000 Sc\n0.500001 0.500001 0.500001 Al\n0.500001 0.500001 0.000000 O\n0.500001 0.000000 0.500001 O\n0.000000 0.500001 0.500001 O\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Sc",
"Al",
"O"
],
"chemical_system": "Al-O-Sc",
"density": 4.163444237550734,
"density_atomic": 0.10452624856818861,
"volume": 47.83487467014763,
"volume_molar": 5.761366970011752,
"formula_full": "Sc1 Al1 O3",
"formula_reduced": "ScAlO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.82429771,
"spacegroup": 221
},
{
"id": "jvasp-40701",
"created_at": "2022-09-04T14:38:05.139484Z",
"updated_at": "2022-09-04T14:38:05.139509Z",
"structure_string": "Li12 Co4 O12\n1.0\n8.563466 -0.000000 0.000000\n-0.000000 8.563466 0.000000\n0.000000 0.000000 3.652422\nLi Co O\n12 4 12\ndirect\n0.365570 0.105257 0.500000 Li\n0.605257 0.134430 0.000000 Li\n0.161424 0.161424 0.000000 Li\n0.661424 0.338576 0.500000 Li\n0.105257 0.365570 0.500000 Li\n0.865570 0.394743 0.000000 Li\n0.134430 0.605257 0.000000 Li\n0.894744 0.634430 0.500000 Li\n0.338576 0.661424 0.500000 Li\n0.838576 0.838576 0.000000 Li\n0.394743 0.865570 0.000000 Li\n0.634430 0.894744 0.500000 Li\n0.118005 0.881996 0.500000 Co\n0.618005 0.618005 0.000000 Co\n0.381996 0.381996 0.000000 Co\n0.881996 0.118005 0.500000 Co\n0.100498 0.100498 0.500000 O\n0.671285 0.112935 0.500000 O\n0.387065 0.171285 0.000000 O\n0.887065 0.328715 0.500000 O\n0.171285 0.387065 0.000000 O\n0.600498 0.399502 0.000000 O\n0.399502 0.600498 0.000000 O\n0.828716 0.612935 0.000000 O\n0.112935 0.671285 0.500000 O\n0.612935 0.828716 0.000000 O\n0.328715 0.887065 0.500000 O\n0.899503 0.899503 0.500000 O\n",
"nsites": 28,
"nelements": 3,
"elements": [
"Li",
"Co",
"O"
],
"chemical_system": "Co-Li-O",
"density": 3.1681434144680627,
"density_atomic": 0.10453889995307711,
"volume": 267.8428796607575,
"volume_molar": 5.760669724574366,
"formula_full": "Li12 Co4 O12",
"formula_reduced": "Li3CoO3",
"formula_anonymous": "AB3C3",
"energy_above_hull": 1.800563057142857,
"spacegroup": 136
},
{
"id": "jvasp-95996",
"created_at": "2022-09-04T14:36:03.596269Z",
"updated_at": "2022-09-04T14:36:03.596293Z",
"structure_string": "Zn2 H8 N4 O16\n1.0\n5.600472 0.000000 -0.018244\n0.000000 5.988716 0.000000\n0.128025 0.000000 8.555735\nZn H N O\n2 8 4 16\ndirect\n0.500000 0.500000 0.000000 Zn\n0.499999 0.000000 0.500001 Zn\n0.696932 0.165553 0.891483 H\n0.303066 0.665553 0.608518 H\n0.303067 0.834448 0.108518 H\n0.696932 0.334448 0.391483 H\n0.911829 0.277688 0.980866 H\n0.088169 0.777688 0.519135 H\n0.088170 0.722313 0.019135 H\n0.911830 0.222313 0.480866 H\n0.243479 0.354580 0.303728 N\n0.756520 0.854581 0.196273 N\n0.243478 0.145420 0.803728 N\n0.756520 0.645420 0.696273 N\n0.229867 0.260705 0.931125 O\n0.261898 0.745500 0.511384 O\n0.738100 0.245499 0.988617 O\n0.229867 0.239295 0.431125 O\n0.770132 0.739295 0.068876 O\n0.770131 0.760706 0.568876 O\n0.451324 0.390976 0.244951 O\n0.060278 0.073794 0.742546 O\n0.548675 0.609025 0.755050 O\n0.451323 0.109025 0.744951 O\n0.060278 0.426207 0.242546 O\n0.939721 0.926207 0.257455 O\n0.939721 0.573794 0.757455 O\n0.261899 0.754501 0.011384 O\n0.548676 0.890976 0.255050 O\n0.738101 0.254501 0.488617 O\n",
"nsites": 30,
"nelements": 4,
"elements": [
"Zn",
"H",
"N",
"O"
],
"chemical_system": "H-N-O-Zn",
"density": 2.60910320058344,
"density_atomic": 0.10454046134823705,
"volume": 286.9702277290162,
"volume_molar": 5.760583684377969,
"formula_full": "Zn2 H8 N4 O16",
"formula_reduced": "ZnH4(NO4)2",
"formula_anonymous": "AB2C4D8",
"energy_above_hull": 3.12172366,
"spacegroup": 14
},
{
"id": "jvasp-110624",
"created_at": "2022-09-04T14:38:38.931080Z",
"updated_at": "2022-09-04T14:38:38.931101Z",
"structure_string": "Fe2 O2 F2\n1.0\n2.880088 0.000000 -0.000000\n-0.000000 4.370062 -0.000028\n0.000000 0.000021 4.560034\nFe O F\n2 2 2\ndirect\n0.500000 0.496730 0.461399 Fe\n0.000000 0.996732 0.038600 Fe\n-0.000000 0.282724 0.321489 O\n0.500000 0.782724 0.178510 O\n0.500000 0.220544 0.820115 F\n-0.000000 0.720544 0.679884 F\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Fe",
"O",
"F"
],
"chemical_system": "F-Fe-O",
"density": 5.256639367185096,
"density_atomic": 0.1045417614480407,
"volume": 57.39333178331912,
"volume_molar": 5.7605120447421605,
"formula_full": "Fe2 O2 F2",
"formula_reduced": "FeOF",
"formula_anonymous": "ABC",
"energy_above_hull": 1.1106230941666666,
"spacegroup": 31
}
]
}