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=-elements&page=4437",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-elements&page=4435",
"results": [
{
"id": "jvasp-29661",
"created_at": "2022-09-04T14:38:15.359182Z",
"updated_at": "2022-09-04T14:38:15.359218Z",
"structure_string": "Cd7 I14\n1.0\n4.286541 -0.000000 0.000000\n-2.143271 3.712254 0.000000\n-0.000000 0.000000 48.133097\nCd I\n7 14\ndirect\n0.666667 0.333333 0.321419 Cd\n0.666667 0.333333 0.464258 Cd\n0.000000 -0.000000 0.607160 Cd\n0.000000 -0.000000 0.749962 Cd\n0.666667 0.333333 0.892845 Cd\n0.666667 0.333333 0.178598 Cd\n0.666667 0.333333 0.035726 Cd\n0.333333 0.666666 0.500297 I\n0.333333 0.666666 0.928873 I\n0.333333 0.666666 0.786001 I\n-0.000000 0.000000 -0.000297 I\n0.333333 0.666666 0.643183 I\n0.000000 -0.000000 0.856833 I\n0.333333 0.666666 0.071749 I\n0.333333 0.666666 0.214622 I\n0.666667 0.333333 0.713954 I\n0.000000 -0.000000 0.428252 I\n0.666667 0.333333 0.571142 I\n0.000000 -0.000000 0.142579 I\n0.333333 0.666666 0.357442 I\n0.000000 -0.000000 0.285402 I\n",
"nsites": 21,
"nelements": 2,
"elements": [
"Cd",
"I"
],
"chemical_system": "Cd-I",
"density": 5.5577710543720595,
"density_atomic": 0.02741768753458528,
"volume": 765.9289272120465,
"volume_molar": 21.96443719917494,
"formula_full": "Cd7 I14",
"formula_reduced": "CdI2",
"formula_anonymous": "AB2",
"energy_above_hull": 9.666666666668931e-05,
"spacegroup": 156
},
{
"id": "jvasp-29674",
"created_at": "2022-09-04T14:37:05.925053Z",
"updated_at": "2022-09-04T14:37:05.925079Z",
"structure_string": "Cd10 I20\n1.0\n4.287000 0.000000 -0.000000\n-2.143500 3.712651 0.000000\n-0.000000 -0.000000 68.778080\nCd I\n10 20\ndirect\n0.666667 0.333333 0.224997 Cd\n0.000000 0.000000 0.825004 Cd\n0.000000 0.000000 0.124991 Cd\n0.666667 0.333333 0.424991 Cd\n0.000000 0.000000 0.524972 Cd\n0.666667 0.333333 0.024993 Cd\n0.666667 0.333333 0.624980 Cd\n0.000000 0.000000 0.924979 Cd\n0.000000 0.000000 0.725010 Cd\n0.000000 0.000000 0.324992 Cd\n0.333333 0.666667 0.050217 I\n0.333333 0.666667 0.850218 I\n0.666667 0.333333 0.499780 I\n0.333333 0.666667 0.250221 I\n0.333333 0.666667 0.150217 I\n0.333333 0.666667 0.550198 I\n0.000000 0.000000 0.999798 I\n0.666667 0.333333 0.299797 I\n0.666667 0.333333 0.099799 I\n0.666667 0.333333 0.899784 I\n0.666667 0.333333 0.699809 I\n0.000000 0.000000 0.599787 I\n0.333333 0.666667 0.950205 I\n0.333333 0.666667 0.650208 I\n0.666667 0.333333 0.799800 I\n0.333333 0.666667 0.350217 I\n0.333333 0.666667 0.450216 I\n0.000000 0.000000 0.199802 I\n0.000000 0.000000 0.399798 I\n0.333333 0.666667 0.750226 I\n",
"nsites": 30,
"nelements": 2,
"elements": [
"Cd",
"I"
],
"chemical_system": "Cd-I",
"density": 5.555247683567043,
"density_atomic": 0.027405239200246026,
"volume": 1094.681195109973,
"volume_molar": 21.974414147590938,
"formula_full": "Cd10 I20",
"formula_reduced": "CdI2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.0001633333333333,
"spacegroup": 156
},
{
"id": "jvasp-29641",
"created_at": "2022-09-04T14:37:08.313967Z",
"updated_at": "2022-09-04T14:37:08.313988Z",
"structure_string": "Cd6 I12\n1.0\n4.285765 -0.000000 0.000000\n-2.142883 3.711581 -0.000000\n0.000000 0.000000 41.251330\nCd I\n6 12\ndirect\n0.333334 0.666667 0.541572 Cd\n0.333334 0.666667 0.374971 Cd\n0.000000 0.000000 0.708373 Cd\n0.666668 0.333333 0.041729 Cd\n0.000000 0.000000 0.208352 Cd\n0.000000 0.000000 0.875001 Cd\n0.666668 0.333333 0.499536 I\n0.666668 0.333333 0.666313 I\n0.000000 0.000000 -0.000293 I\n0.000000 0.000000 0.416993 I\n0.333334 0.666667 0.750403 I\n0.666668 0.333333 0.832972 I\n0.333334 0.666667 0.917061 I\n0.333334 0.666667 0.250378 I\n0.000000 0.000000 0.583608 I\n0.333334 0.666667 0.083777 I\n0.666668 0.333333 0.332925 I\n0.666668 0.333333 0.166326 I\n",
"nsites": 18,
"nelements": 2,
"elements": [
"Cd",
"I"
],
"chemical_system": "Cd-I",
"density": 5.560541456149535,
"density_atomic": 0.02743135452617902,
"volume": 656.1834189712273,
"volume_molar": 21.953493963459916,
"formula_full": "Cd6 I12",
"formula_reduced": "CdI2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.00017,
"spacegroup": 156
},
{
"id": "jvasp-29637",
"created_at": "2022-09-04T14:37:13.536372Z",
"updated_at": "2022-09-04T14:37:13.536391Z",
"structure_string": "Cd6 I12\n1.0\n4.285893 0.000000 0.000000\n-2.142947 3.711693 0.000000\n0.000000 0.000000 41.277824\nCd I\n6 12\ndirect\n0.666666 0.333333 0.041655 Cd\n0.666666 0.333333 0.375012 Cd\n0.000000 0.000000 0.708354 Cd\n0.666666 0.333333 0.541636 Cd\n0.000000 0.000000 0.208317 Cd\n0.000000 0.000000 0.874955 Cd\n0.333332 0.666666 0.250353 I\n0.666666 0.333333 0.832962 I\n0.000000 0.000000 -0.000338 I\n0.000000 0.000000 0.333008 I\n0.333332 0.666666 0.916993 I\n0.666666 0.333333 0.666351 I\n0.333332 0.666666 0.583675 I\n0.000000 0.000000 0.499641 I\n0.333332 0.666666 0.417034 I\n0.333332 0.666666 0.083693 I\n0.333332 0.666666 0.750375 I\n0.666666 0.333333 0.166326 I\n",
"nsites": 18,
"nelements": 2,
"elements": [
"Cd",
"I"
],
"chemical_system": "Cd-I",
"density": 5.5566388082410345,
"density_atomic": 0.0274121019193577,
"volume": 656.6442826220808,
"volume_molar": 21.968912773329958,
"formula_full": "Cd6 I12",
"formula_reduced": "CdI2",
"formula_anonymous": "AB2",
"energy_above_hull": 9.9999999999989e-05,
"spacegroup": 156
},
{
"id": "jvasp-29639",
"created_at": "2022-09-04T14:37:12.690334Z",
"updated_at": "2022-09-04T14:37:12.690348Z",
"structure_string": "Cd6 I12\n1.0\n4.285527 0.000000 -0.000000\n-2.142764 3.711377 0.000000\n-0.000000 0.000000 41.289410\nCd I\n6 12\ndirect\n0.000000 0.000000 0.541628 Cd\n0.333334 0.666668 0.708323 Cd\n0.000000 0.000000 0.874996 Cd\n0.666668 0.333333 0.041677 Cd\n0.666668 0.333333 0.374988 Cd\n0.000000 0.000000 0.208352 Cd\n0.333334 0.666668 0.250379 I\n0.333334 0.666668 0.417013 I\n0.666668 0.333333 0.499629 I\n0.666668 0.333333 0.666302 I\n0.000000 0.000000 -0.000314 I\n0.000000 0.000000 0.333001 I\n0.333334 0.666668 0.917012 I\n0.000000 0.000000 0.750322 I\n0.666668 0.333333 0.832987 I\n0.333334 0.666668 0.083706 I\n0.333334 0.666668 0.583636 I\n0.666668 0.333333 0.166364 I\n",
"nsites": 18,
"nelements": 2,
"elements": [
"Cd",
"I"
],
"chemical_system": "Cd-I",
"density": 5.556027034012476,
"density_atomic": 0.02740908390467587,
"volume": 656.7165857348949,
"volume_molar": 21.97133177067859,
"formula_full": "Cd6 I12",
"formula_reduced": "CdI2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.0001066666666666,
"spacegroup": 156
},
{
"id": "jvasp-29638",
"created_at": "2022-09-04T14:37:13.714572Z",
"updated_at": "2022-09-04T14:37:13.714595Z",
"structure_string": "Cd6 I12\n1.0\n4.285846 0.000000 0.000000\n-2.142923 3.711651 0.000000\n-0.000000 0.000000 41.240332\nCd I\n6 12\ndirect\n-0.000000 -0.000000 0.542035 Cd\n0.666668 0.333333 0.041829 Cd\n-0.000000 -0.000000 0.708629 Cd\n0.666668 0.333333 0.375319 Cd\n-0.000000 -0.000000 0.208582 Cd\n-0.000000 -0.000000 0.875196 Cd\n0.333334 0.666667 0.584086 I\n0.666668 0.333333 0.500003 I\n0.666668 0.333333 0.833174 I\n-0.000000 -0.000000 0.999807 I\n-0.000000 -0.000000 0.333293 I\n0.666668 0.333333 0.666601 I\n0.333334 0.666667 0.750680 I\n0.333334 0.666667 0.250651 I\n0.333334 0.666667 0.417390 I\n0.333334 0.666667 0.083905 I\n0.333334 0.666667 0.917263 I\n0.666668 0.333333 0.166555 I\n",
"nsites": 18,
"nelements": 2,
"elements": [
"Cd",
"I"
],
"chemical_system": "Cd-I",
"density": 5.561814330933848,
"density_atomic": 0.027437633892990924,
"volume": 656.0332450750495,
"volume_molar": 21.94846969489736,
"formula_full": "Cd6 I12",
"formula_reduced": "CdI2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.0001833333333333,
"spacegroup": 156
},
{
"id": "jvasp-107905",
"created_at": "2022-09-04T14:37:50.091350Z",
"updated_at": "2022-09-04T14:37:50.091373Z",
"structure_string": "Cd1 Hg3\n1.0\n4.252899 0.204860 -4.523990\n-0.521454 4.225778 -4.523990\n-0.172531 -0.204860 6.206760\nCd Hg\n1 3\ndirect\n0.000000 0.000000 0.000000 Cd\n0.750001 0.250000 0.500001 Hg\n0.250001 0.750000 0.500001 Hg\n0.500001 0.500000 0.000001 Hg\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Cd",
"Hg"
],
"chemical_system": "Cd-Hg",
"density": 11.332682269460385,
"density_atomic": 0.038223928017480945,
"volume": 104.64649258890087,
"volume_molar": 15.754897710266446,
"formula_full": "Cd1 Hg3",
"formula_reduced": "CdHg3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.00092,
"spacegroup": 139
},
{
"id": "jvasp-104841",
"created_at": "2022-09-04T14:36:40.891764Z",
"updated_at": "2022-09-04T14:36:40.891786Z",
"structure_string": "Cd1 Hg3\n1.0\n4.595493 -0.000000 2.653209\n1.531831 4.332672 2.653209\n-0.000000 -0.000000 5.306418\nCd Hg\n1 3\ndirect\n0.000000 0.000000 0.000000 Cd\n0.250000 0.250000 0.250000 Hg\n0.750000 0.750000 0.750001 Hg\n0.500000 0.500000 0.500001 Hg\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Cd",
"Hg"
],
"chemical_system": "Cd-Hg",
"density": 11.224526010275735,
"density_atomic": 0.03785912849628949,
"volume": 105.65483567304074,
"volume_molar": 15.906707309943018,
"formula_full": "Cd1 Hg3",
"formula_reduced": "CdHg3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-16473",
"created_at": "2022-09-04T14:38:17.414125Z",
"updated_at": "2022-09-04T14:38:17.414146Z",
"structure_string": "Cd2 Hg1\n1.0\n3.721290 0.000000 -1.535722\n-0.633771 3.666925 -1.535722\n-0.019864 -0.023592 5.228356\nCd Hg\n2 1\ndirect\n0.333886 0.333886 0.667772 Cd\n0.666116 0.666116 0.332231 Cd\n0.000000 0.000000 0.000000 Hg\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Cd",
"Hg"
],
"chemical_system": "Cd-Hg",
"density": 9.93899971774104,
"density_atomic": 0.04220900350802593,
"volume": 71.07488333453686,
"volume_molar": 14.267431731371975,
"formula_full": "Cd2 Hg1",
"formula_reduced": "Cd2Hg",
"formula_anonymous": "AB2",
"energy_above_hull": 0.2081083333333333,
"spacegroup": 139
},
{
"id": "jvasp-103593",
"created_at": "2022-09-04T14:36:35.701325Z",
"updated_at": "2022-09-04T14:36:35.701351Z",
"structure_string": "Cd2 Hg6\n1.0\n6.752628 0.000000 0.000000\n-3.376313 5.847948 0.000000\n-0.000000 0.000000 5.327964\nCd Hg\n2 6\ndirect\n0.333334 0.666667 0.749999 Cd\n0.666667 0.333333 0.250000 Cd\n0.168260 0.336520 0.250000 Hg\n0.663481 0.831741 0.250000 Hg\n0.168260 0.831741 0.250000 Hg\n0.831741 0.663480 0.749999 Hg\n0.336520 0.168259 0.749999 Hg\n0.831741 0.168259 0.749999 Hg\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Cd",
"Hg"
],
"chemical_system": "Cd-Hg",
"density": 11.273266556558443,
"density_atomic": 0.038023525157939796,
"volume": 210.39606314170211,
"volume_molar": 15.837933844864725,
"formula_full": "Cd2 Hg6",
"formula_reduced": "CdHg3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0015775,
"spacegroup": 194
},
{
"id": "jvasp-18647",
"created_at": "2022-09-04T14:37:01.156800Z",
"updated_at": "2022-09-04T14:37:01.156814Z",
"structure_string": "Cd1 Hg2\n1.0\n3.652836 0.000000 -1.528379\n-0.639488 3.596424 -1.528379\n0.193026 0.230376 5.590674\nCd Hg\n1 2\ndirect\n0.000000 0.000000 0.000000 Cd\n0.336071 0.336070 0.672141 Hg\n0.663931 0.663930 0.327859 Hg\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Cd",
"Hg"
],
"chemical_system": "Cd-Hg",
"density": 11.218916978470654,
"density_atomic": 0.03946441657415265,
"volume": 76.01784747946482,
"volume_molar": 15.259672593118278,
"formula_full": "Cd1 Hg2",
"formula_reduced": "CdHg2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.2164583333333332,
"spacegroup": 139
},
{
"id": "jvasp-111379",
"created_at": "2022-09-04T14:38:26.256947Z",
"updated_at": "2022-09-04T14:38:26.256969Z",
"structure_string": "Cd3 Hg1\n1.0\n3.112140 -0.000000 0.000000\n-1.556070 2.695192 0.000000\n-0.000000 -0.000000 11.212629\nCd Hg\n3 1\ndirect\n0.000000 0.000000 0.000000 Cd\n0.333333 0.666666 0.753258 Cd\n0.333333 0.666666 0.246742 Cd\n0.000000 0.000000 0.500000 Hg\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Cd",
"Hg"
],
"chemical_system": "Cd-Hg",
"density": 9.495813608229495,
"density_atomic": 0.042530814932974954,
"volume": 94.04945581935519,
"volume_molar": 14.159476533638953,
"formula_full": "Cd3 Hg1",
"formula_reduced": "Cd3Hg",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 187
}
]
}