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=-energy_above_hull&page=1528",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-energy_above_hull&page=1526",
"results": [
{
"id": "jvasp-17613",
"created_at": "2022-09-04T14:38:31.071063Z",
"updated_at": "2022-09-04T14:38:31.071091Z",
"structure_string": "Ti1 Ga1 Co2\n1.0\n3.561494 0.000000 2.056230\n1.187164 3.357808 2.056230\n-0.000000 -0.000000 4.112458\nTi Ga Co\n1 1 2\ndirect\n0.499999 0.500000 0.500001 Ti\n0.000000 0.000000 0.000000 Ga\n0.749998 0.750000 0.750001 Co\n0.249999 0.250000 0.250000 Co\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ti",
"Ga",
"Co"
],
"chemical_system": "Co-Ga-Ti",
"density": 7.950053047255313,
"density_atomic": 0.08133368309364375,
"volume": 49.180116378039706,
"volume_molar": 7.404239585543412,
"formula_full": "Ti1 Ga1 Co2",
"formula_reduced": "TiGaCo2",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.3546581145833336,
"spacegroup": 225
},
{
"id": "jvasp-47537",
"created_at": "2022-09-04T14:35:47.851278Z",
"updated_at": "2022-09-04T14:35:47.851307Z",
"structure_string": "Li2 Ti1 Co1 O4\n1.0\n-5.122958 0.154892 0.000000\n-1.510085 2.414483 2.847821\n-1.510085 2.414483 -2.847821\nLi Ti Co O\n2 1 1 4\ndirect\n0.500000 0.749999 0.249999 Li\n-0.000001 0.499999 0.499999 Li\n0.500000 0.249999 0.749999 Ti\n0.000000 0.000000 0.000000 Co\n0.965745 0.017128 0.517128 O\n0.503056 0.748471 0.748471 O\n0.496943 0.251528 0.251528 O\n0.034255 0.482870 0.982870 O\n",
"nsites": 8,
"nelements": 4,
"elements": [
"Li",
"Ti",
"Co",
"O"
],
"chemical_system": "Co-Li-O-Ti",
"density": 4.436820751751937,
"density_atomic": 0.11574264137849083,
"volume": 69.1188649638567,
"volume_molar": 5.203044174797216,
"formula_full": "Li2 Ti1 Co1 O4",
"formula_reduced": "Li2TiCoO4",
"formula_anonymous": "ABC2D4",
"energy_above_hull": 2.3545666541666668,
"spacegroup": 119
},
{
"id": "jvasp-11031",
"created_at": "2022-09-04T14:37:16.912841Z",
"updated_at": "2022-09-04T14:37:16.912859Z",
"structure_string": "Ca2 Fe4 O8\n1.0\n2.926509 0.001814 0.002209\n1.458984 6.866941 -0.145194\n1.455620 2.486637 7.791117\nCa Fe O\n2 4 8\ndirect\n0.381097 0.086793 0.150834 Ca\n0.612913 0.947338 0.826790 Ca\n0.587353 0.625218 0.199985 Fe\n0.159711 0.216916 0.463563 Fe\n0.842695 0.801743 0.512764 Fe\n0.406351 0.402947 0.784224 Fe\n0.839169 0.589022 0.732535 O\n0.438419 0.752135 0.370912 O\n0.562529 0.289539 0.585328 O\n0.149406 0.432014 0.269056 O\n0.066338 0.807692 0.059567 O\n0.769978 0.104757 0.355140 O\n0.933643 0.223844 0.908714 O\n0.217157 0.945657 0.619929 O\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Ca",
"Fe",
"O"
],
"chemical_system": "Ca-Fe-O",
"density": 4.546991021553266,
"density_atomic": 0.08883637606272254,
"volume": 157.59310116517315,
"volume_molar": 6.778913128725663,
"formula_full": "Ca2 Fe4 O8",
"formula_reduced": "Ca(FeO2)2",
"formula_anonymous": "AB2C4",
"energy_above_hull": 2.354513631428571,
"spacegroup": 8
},
{
"id": "jvasp-37884",
"created_at": "2022-09-04T14:35:53.556321Z",
"updated_at": "2022-09-04T14:35:53.556335Z",
"structure_string": "Cr3 Cd1 Te4\n1.0\n6.312299 -0.000000 0.000000\n0.000000 6.312299 -0.000000\n0.000000 -0.000000 6.312299\nCr Cd Te\n3 1 4\ndirect\n0.000000 0.500000 0.500000 Cr\n0.500000 0.000000 0.500000 Cr\n0.500000 0.500000 0.000000 Cr\n0.000000 0.000000 0.000000 Cd\n0.261494 0.261494 0.261494 Te\n0.738506 0.738506 0.261494 Te\n0.261494 0.738506 0.738506 Te\n0.738506 0.261494 0.738506 Te\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Cr",
"Cd",
"Te"
],
"chemical_system": "Cd-Cr-Te",
"density": 5.141761914827884,
"density_atomic": 0.03180733625846998,
"volume": 251.5143027064921,
"volume_molar": 18.933181675646804,
"formula_full": "Cr3 Cd1 Te4",
"formula_reduced": "Cr3CdTe4",
"formula_anonymous": "AB3C4",
"energy_above_hull": 2.3544616270833334,
"spacegroup": 215
},
{
"id": "jvasp-111675",
"created_at": "2022-09-04T14:38:40.722473Z",
"updated_at": "2022-09-04T14:38:40.722499Z",
"structure_string": "In2 As2 H4 O10\n1.0\n5.505528 0.000641 -0.435932\n-1.769789 5.411117 -0.848389\n-0.011651 -0.054934 6.749738\nIn As H O\n2 2 4 10\ndirect\n0.631012 0.725988 0.221474 In\n0.368989 0.274013 0.778526 In\n0.738017 0.879649 0.742824 As\n0.261984 0.120352 0.257176 As\n0.891555 0.362302 0.271964 H\n0.108446 0.637699 0.728037 H\n0.071462 0.615673 0.210947 H\n0.928539 0.384328 0.789054 H\n0.940907 0.071456 0.270021 O\n0.059093 0.928545 0.729980 O\n0.458409 0.240490 0.479223 O\n0.541592 0.759511 0.520778 O\n0.651525 0.651881 0.891718 O\n0.691367 0.147829 0.859599 O\n0.348476 0.348120 0.108283 O\n0.917985 0.542631 0.276367 O\n0.308634 0.852172 0.140402 O\n0.082015 0.457370 0.723634 O\n",
"nsites": 18,
"nelements": 4,
"elements": [
"In",
"As",
"H",
"O"
],
"chemical_system": "As-H-In-O",
"density": 4.495405345355747,
"density_atomic": 0.08965793944220783,
"volume": 200.76303461783806,
"volume_molar": 6.716795854852076,
"formula_full": "In2 As2 H4 O10",
"formula_reduced": "InAsH2O5",
"formula_anonymous": "ABC2D5",
"energy_above_hull": 2.3541821355555554,
"spacegroup": 2
},
{
"id": "jvasp-79012",
"created_at": "2022-09-04T14:36:36.608405Z",
"updated_at": "2022-09-04T14:36:36.608430Z",
"structure_string": "La2 Pd1 Ru1\n1.0\n0.000000 3.617147 3.617147\n3.617147 -0.000000 3.617147\n3.617147 3.617147 -0.000000\nLa Pd Ru\n2 1 1\ndirect\n0.000000 0.000000 0.000000 La\n0.499999 0.499999 0.499999 La\n0.250001 0.250001 0.250001 Pd\n0.750001 0.750001 0.750001 Ru\n",
"nsites": 4,
"nelements": 3,
"elements": [
"La",
"Pd",
"Ru"
],
"chemical_system": "La-Pd-Ru",
"density": 8.513962992093383,
"density_atomic": 0.04226019721415394,
"volume": 94.65171162666287,
"volume_molar": 14.25014826476731,
"formula_full": "La2 Pd1 Ru1",
"formula_reduced": "La2PdRu",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.35405655,
"spacegroup": 225
},
{
"id": "jvasp-78864",
"created_at": "2022-09-04T14:36:40.036011Z",
"updated_at": "2022-09-04T14:36:40.036035Z",
"structure_string": "Hf2 Mg2\n1.0\n5.005836 -0.000000 -0.000000\n-2.502918 4.335181 0.000000\n0.000000 0.000000 5.600128\nHf Mg\n2 2\ndirect\n0.333333 0.666667 0.062504 Hf\n0.666667 0.333333 0.562504 Hf\n0.333333 0.666667 0.562497 Mg\n0.666667 0.333333 0.062497 Mg\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Hf",
"Mg"
],
"chemical_system": "Hf-Mg",
"density": 5.5418469893018845,
"density_atomic": 0.03291381212701637,
"volume": 121.52952640562451,
"volume_molar": 18.29669786277019,
"formula_full": "Hf2 Mg2",
"formula_reduced": "HfMg",
"formula_anonymous": "AB",
"energy_above_hull": 2.3540177142857144,
"spacegroup": 194
},
{
"id": "jvasp-23746",
"created_at": "2022-09-04T14:37:40.626541Z",
"updated_at": "2022-09-04T14:37:40.626568Z",
"structure_string": "Ho4 Si4 Ir4\n1.0\n4.239302 -0.000000 0.000000\n-0.000000 6.841279 0.000000\n0.000000 0.000000 7.416891\nHo Si Ir\n4 4 4\ndirect\n0.750000 0.499737 0.812537 Ho\n0.250000 0.000263 0.312537 Ho\n0.750000 0.999737 0.687463 Ho\n0.250000 0.500263 0.187463 Ho\n0.250000 0.798345 0.891806 Si\n0.250000 0.298345 0.608194 Si\n0.750000 0.201655 0.108194 Si\n0.750000 0.701655 0.391806 Si\n0.250000 0.660344 0.570106 Ir\n0.250000 0.160344 0.929894 Ir\n0.750000 0.839656 0.070106 Ir\n0.750000 0.339656 0.429894 Ir\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Ho",
"Si",
"Ir"
],
"chemical_system": "Ho-Ir-Si",
"density": 11.895393523236704,
"density_atomic": 0.055786317129428026,
"volume": 215.10651029640815,
"volume_molar": 10.795014028311327,
"formula_full": "Ho4 Si4 Ir4",
"formula_reduced": "HoSiIr",
"formula_anonymous": "ABC",
"energy_above_hull": 2.353731755555555,
"spacegroup": 62
},
{
"id": "jvasp-29418",
"created_at": "2022-09-04T14:37:52.623163Z",
"updated_at": "2022-09-04T14:37:52.623180Z",
"structure_string": "Dy4 Te10 O26\n1.0\n6.962750 0.001819 0.370863\n2.215757 8.345491 0.122720\n-0.018841 -0.018927 10.556959\nDy Te O\n4 10 26\ndirect\n0.554205 0.529265 0.179642 Dy\n0.997864 0.735051 0.237839 Dy\n0.002137 0.264949 0.762161 Dy\n0.445796 0.470735 0.820357 Dy\n0.874854 0.654534 0.892889 Te\n0.156611 0.803271 0.633009 Te\n0.125147 0.345465 0.107111 Te\n0.566998 0.091344 0.695012 Te\n0.843390 0.196729 0.366991 Te\n0.709363 0.117280 0.029320 Te\n0.726273 0.606708 0.520752 Te\n0.290638 0.882719 0.970680 Te\n0.273728 0.393292 0.479248 Te\n0.433002 0.908656 0.304988 Te\n0.344017 0.990623 0.124865 O\n0.533611 0.325581 0.002929 O\n0.538233 0.810261 0.487048 O\n0.044585 0.349061 0.562320 O\n0.933711 0.732378 0.718045 O\n0.940226 0.981963 0.314399 O\n0.955416 0.650939 0.437680 O\n0.671456 0.256768 0.229836 O\n0.941053 0.179663 0.966128 O\n0.338335 0.512079 0.614655 O\n0.238800 0.494283 0.186746 O\n0.059775 0.018037 0.685600 O\n0.328545 0.743231 0.770164 O\n0.466390 0.674419 0.997071 O\n0.687579 0.262879 0.710221 O\n0.058948 0.820337 0.033872 O\n0.667379 0.779847 0.223337 O\n0.761200 0.505717 0.813254 O\n0.312422 0.737121 0.289779 O\n0.661666 0.487920 0.385345 O\n0.461767 0.189738 0.512952 O\n0.879172 0.512194 0.108169 O\n0.120828 0.487805 0.891831 O\n0.655983 0.009377 0.875135 O\n0.066290 0.267621 0.281954 O\n0.332622 0.220152 0.776662 O\n",
"nsites": 40,
"nelements": 3,
"elements": [
"Dy",
"Te",
"O"
],
"chemical_system": "Dy-O-Te",
"density": 6.339426479460715,
"density_atomic": 0.06520439437628502,
"volume": 613.4555865846381,
"volume_molar": 9.235789731052646,
"formula_full": "Dy4 Te10 O26",
"formula_reduced": "Dy2Te5O13",
"formula_anonymous": "A2B5C13",
"energy_above_hull": 2.3534338666666668,
"spacegroup": 2
},
{
"id": "jvasp-26765",
"created_at": "2022-09-04T14:38:27.607563Z",
"updated_at": "2022-09-04T14:38:27.607586Z",
"structure_string": "Dy4 Te10 O26\n1.0\n6.972750 -0.018635 0.018045\n-2.243286 -8.339104 -0.012549\n-0.514085 0.023978 -10.545461\nDy Te O\n4 10 26\ndirect\n0.554211 0.470737 0.820370 Dy\n0.997863 0.264951 0.762158 Dy\n0.002137 0.735048 0.237842 Dy\n0.445789 0.529263 0.179631 Dy\n0.874876 0.345467 0.107127 Te\n0.156584 0.196741 0.366966 Te\n0.125124 0.654533 0.892873 Te\n0.567000 0.908652 0.304990 Te\n0.843416 0.803258 0.633035 Te\n0.709365 0.882698 0.970704 Te\n0.726276 0.393276 0.479273 Te\n0.290635 0.117302 0.029296 Te\n0.273724 0.606724 0.520727 Te\n0.433000 0.091348 0.695011 Te\n0.344020 0.009389 0.875120 O\n0.533612 0.674403 0.997076 O\n0.538221 0.189746 0.512960 O\n0.044600 0.650953 0.437671 O\n0.933695 0.267644 0.281954 O\n0.940287 0.018030 0.685604 O\n0.955400 0.349046 0.562330 O\n0.671497 0.743237 0.770188 O\n0.941041 0.820319 0.033889 O\n0.338331 0.487916 0.385325 O\n0.238813 0.505720 0.813249 O\n0.059713 0.981970 0.314396 O\n0.328503 0.256763 0.229812 O\n0.466388 0.325596 0.002925 O\n0.687563 0.737111 0.289763 O\n0.058959 0.179680 0.966111 O\n0.667374 0.220140 0.776647 O\n0.761187 0.494280 0.186751 O\n0.312438 0.262888 0.710238 O\n0.661669 0.512084 0.614675 O\n0.461780 0.810254 0.487040 O\n0.879179 0.487792 0.891823 O\n0.120821 0.512208 0.108177 O\n0.655980 0.990611 0.124881 O\n0.066305 0.732356 0.718046 O\n0.332626 0.779860 0.223354 O\n",
"nsites": 40,
"nelements": 3,
"elements": [
"Dy",
"Te",
"O"
],
"chemical_system": "Dy-O-Te",
"density": 6.338492266526696,
"density_atomic": 0.06519478549624222,
"volume": 613.546002115546,
"volume_molar": 9.237150968687688,
"formula_full": "Dy4 Te10 O26",
"formula_reduced": "Dy2Te5O13",
"formula_anonymous": "A2B5C13",
"energy_above_hull": 2.353430866666667,
"spacegroup": 2
},
{
"id": "jvasp-100513",
"created_at": "2022-09-04T14:36:38.005926Z",
"updated_at": "2022-09-04T14:36:38.005946Z",
"structure_string": "Tm1 Rh3\n1.0\n4.006778 0.000000 -0.000000\n-0.000000 4.006778 -0.000000\n0.000000 0.000000 4.006778\nTm Rh\n1 3\ndirect\n0.000000 0.000000 0.000000 Tm\n0.000000 0.500000 0.500000 Rh\n0.500000 0.000000 0.500000 Rh\n0.500000 0.500000 0.000000 Rh\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Tm",
"Rh"
],
"chemical_system": "Rh-Tm",
"density": 12.330301143298898,
"density_atomic": 0.062183354965636525,
"volume": 64.32589560679801,
"volume_molar": 9.684489946430082,
"formula_full": "Tm1 Rh3",
"formula_reduced": "TmRh3",
"formula_anonymous": "AB3",
"energy_above_hull": 2.3532833125,
"spacegroup": 221
},
{
"id": "jvasp-16544",
"created_at": "2022-09-04T14:38:17.150329Z",
"updated_at": "2022-09-04T14:38:17.150342Z",
"structure_string": "Hf1 Rh1\n1.0\n3.260766 0.000000 0.000000\n0.000000 3.260766 0.000000\n-0.000000 0.000000 3.260766\nHf Rh\n1 1\ndirect\n0.000000 0.000000 0.000000 Hf\n0.500001 0.500001 0.500001 Rh\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Hf",
"Rh"
],
"chemical_system": "Hf-Rh",
"density": 13.477438030556538,
"density_atomic": 0.057686088748566955,
"volume": 34.67040396372313,
"volume_molar": 10.43950264378013,
"formula_full": "Hf1 Rh1",
"formula_reduced": "HfRh",
"formula_anonymous": "AB",
"energy_above_hull": 2.353213,
"spacegroup": 221
}
]
}