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=4344",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-nelements&page=4342",
"results": [
{
"id": "jvasp-29544",
"created_at": "2022-09-04T14:38:01.606132Z",
"updated_at": "2022-09-04T14:38:01.606163Z",
"structure_string": "Cd9 I18\n1.0\n4.286487 -0.000000 0.000000\n-2.143243 3.712207 -0.000000\n0.000000 -0.000000 61.918829\nCd I\n9 18\ndirect\n0.333334 0.666668 0.361083 Cd\n0.333334 0.666668 0.583312 Cd\n0.333334 0.666668 0.916661 Cd\n0.666668 0.333333 0.027805 Cd\n0.666668 0.333333 0.250021 Cd\n0.333334 0.666668 0.805587 Cd\n0.333334 0.666668 0.138893 Cd\n-0.000000 0.000000 0.472210 Cd\n-0.000000 0.000000 0.694427 Cd\n0.666668 0.333333 0.611326 I\n-0.000000 0.000000 0.333077 I\n0.666668 0.333333 0.944667 I\n0.666668 0.333333 0.389090 I\n-0.000000 0.000000 0.555317 I\n0.333334 0.666668 0.444214 I\n0.000000 -0.000000 -0.000210 I\n0.666668 0.333333 0.500225 I\n-0.000000 0.000000 0.777581 I\n0.666668 0.333333 0.833590 I\n-0.000000 0.000000 0.110877 I\n0.666668 0.333333 0.166887 I\n0.333334 0.666668 0.278016 I\n0.666668 0.333333 0.722443 I\n0.333334 0.666668 0.666431 I\n-0.000000 0.000000 0.222007 I\n0.333334 0.666668 0.055800 I\n-0.000000 0.000000 0.888659 I\n",
"nsites": 27,
"nelements": 2,
"elements": [
"Cd",
"I"
],
"chemical_system": "Cd-I",
"density": 5.5549117443945155,
"density_atomic": 0.027403581939597313,
"volume": 985.2726574034415,
"volume_molar": 21.975743073565855,
"formula_full": "Cd9 I18",
"formula_reduced": "CdI2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.0001666666666667,
"spacegroup": 164
},
{
"id": "jvasp-37715",
"created_at": "2022-09-04T14:38:01.639991Z",
"updated_at": "2022-09-04T14:38:01.640016Z",
"structure_string": "Tb6 H18\n1.0\n3.190766 -5.526570 -0.000000\n3.190766 5.526570 0.000000\n0.000000 0.000000 6.648488\nTb H\n6 18\ndirect\n0.000000 0.337546 0.750000 Tb\n0.337546 0.000000 0.750000 Tb\n0.662455 0.662455 0.750000 Tb\n0.662454 0.000000 0.250000 Tb\n0.000000 0.662454 0.250000 Tb\n0.337547 0.337547 0.250000 Tb\n0.032338 0.352868 0.090693 H\n0.666668 0.333334 0.184787 H\n0.000000 0.000000 0.250000 H\n0.333334 0.666668 0.315213 H\n0.967663 0.320530 0.409307 H\n0.352868 0.032338 0.409307 H\n0.679472 0.647133 0.409307 H\n0.320530 0.352869 0.590693 H\n0.666668 0.333334 0.684787 H\n0.032338 0.679471 0.590693 H\n0.647133 0.679472 0.090693 H\n0.000000 0.000000 0.750000 H\n0.333334 0.666668 0.815213 H\n0.967663 0.647133 0.909307 H\n0.352869 0.320530 0.909307 H\n0.679471 0.032338 0.909307 H\n0.647133 0.967663 0.590693 H\n0.320530 0.967663 0.090693 H\n",
"nsites": 24,
"nelements": 2,
"elements": [
"Tb",
"H"
],
"chemical_system": "H-Tb",
"density": 6.881380281337676,
"density_atomic": 0.10235468497090755,
"volume": 234.4787637890885,
"volume_molar": 5.883600503202842,
"formula_full": "Tb6 H18",
"formula_reduced": "TbH3",
"formula_anonymous": "AB3",
"energy_above_hull": 2.1161096,
"spacegroup": 165
},
{
"id": "jvasp-78379",
"created_at": "2022-09-04T14:38:01.692219Z",
"updated_at": "2022-09-04T14:38:01.692246Z",
"structure_string": "Rb1 S1\n1.0\n2.790641 1.611178 2.278566\n-2.790641 1.611178 2.278566\n0.000000 -3.222355 2.278566\nRb S\n1 1\ndirect\n0.000000 0.000000 0.000000 Rb\n0.500001 0.500001 0.500000 S\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Rb",
"S"
],
"chemical_system": "Rb-S",
"density": 3.1750305839771737,
"density_atomic": 0.032536417239482376,
"volume": 61.46958299923185,
"volume_molar": 18.50892406399386,
"formula_full": "Rb1 S1",
"formula_reduced": "RbS",
"formula_anonymous": "AB",
"energy_above_hull": 0.2772924999999999,
"spacegroup": 221
},
{
"id": "jvasp-14009",
"created_at": "2022-09-04T14:38:01.710517Z",
"updated_at": "2022-09-04T14:38:01.710535Z",
"structure_string": "Dy2 Ge2\n1.0\n3.972647 -0.000000 -0.000000\n-0.000000 3.979757 -1.513854\n0.000000 -0.086122 5.761696\nDy Ge\n2 2\ndirect\n0.250000 0.862477 0.724954 Dy\n0.750000 0.137524 0.275048 Dy\n0.250000 0.587621 0.175241 Ge\n0.750000 0.412380 0.824761 Ge\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Dy",
"Ge"
],
"chemical_system": "Dy-Ge",
"density": 8.621743360332395,
"density_atomic": 0.04416207547032406,
"volume": 90.57545320051616,
"volume_molar": 13.636453214357521,
"formula_full": "Dy2 Ge2",
"formula_reduced": "DyGe",
"formula_anonymous": "AB",
"energy_above_hull": 0.293171225,
"spacegroup": 63
},
{
"id": "jvasp-79554",
"created_at": "2022-09-04T14:38:01.731367Z",
"updated_at": "2022-09-04T14:38:01.731385Z",
"structure_string": "Ti2 Si2\n1.0\n3.642692 0.000000 -0.000000\n1.821345 -3.830014 2.120398\n1.821345 -3.830014 -2.120398\nTi Si\n2 2\ndirect\n0.000002 0.050772 0.949227 Ti\n0.500002 0.550773 0.449226 Ti\n0.749994 0.800735 0.699281 Si\n0.250009 0.300718 0.199264 Si\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ti",
"Si"
],
"chemical_system": "Si-Ti",
"density": 4.263349842434278,
"density_atomic": 0.06760670911197288,
"volume": 59.16572559943783,
"volume_molar": 8.90760819318375,
"formula_full": "Ti2 Si2",
"formula_reduced": "TiSi",
"formula_anonymous": "AB",
"energy_above_hull": 2.087988466666666,
"spacegroup": 65
},
{
"id": "jvasp-38745",
"created_at": "2022-09-04T14:38:01.751616Z",
"updated_at": "2022-09-04T14:38:01.751637Z",
"structure_string": "Os1 Au3\n1.0\n4.082254 0.000000 0.000000\n0.000000 4.082254 0.000000\n-0.000000 0.000000 4.082254\nOs Au\n1 3\ndirect\n0.000000 0.000000 0.000000 Os\n0.000000 0.499999 0.499999 Au\n0.499999 0.000000 0.499999 Au\n0.499999 0.499999 0.000000 Au\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Os",
"Au"
],
"chemical_system": "Au-Os",
"density": 19.066552885731742,
"density_atomic": 0.058797643616204494,
"volume": 68.02993715376732,
"volume_molar": 10.242146435848516,
"formula_full": "Os1 Au3",
"formula_reduced": "OsAu3",
"formula_anonymous": "AB3",
"energy_above_hull": 1.9752769275,
"spacegroup": 221
},
{
"id": "jvasp-39992",
"created_at": "2022-09-04T14:38:01.674465Z",
"updated_at": "2022-09-04T14:38:01.674491Z",
"structure_string": "Er2 Hg6\n1.0\n3.293282 -5.704131 -0.000000\n3.293282 5.704131 0.000000\n-0.000000 0.000000 4.977574\nEr Hg\n2 6\ndirect\n0.333333 0.666667 0.749999 Er\n0.666667 0.333333 0.250000 Er\n0.167755 0.335510 0.250000 Hg\n0.664490 0.832244 0.250000 Hg\n0.167755 0.832244 0.250000 Hg\n0.832244 0.664490 0.749999 Hg\n0.335510 0.167755 0.749999 Hg\n0.832244 0.167755 0.749999 Hg\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Er",
"Hg"
],
"chemical_system": "Er-Hg",
"density": 13.65701159642922,
"density_atomic": 0.04277833279268844,
"volume": 187.01056066793092,
"volume_molar": 14.077548999359996,
"formula_full": "Er2 Hg6",
"formula_reduced": "ErHg3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 194
},
{
"id": "jvasp-33856",
"created_at": "2022-09-04T14:38:01.690022Z",
"updated_at": "2022-09-04T14:38:01.690037Z",
"structure_string": "Y2 Mg6\n1.0\n6.670291 0.000000 0.000000\n-3.335146 5.776641 -0.000000\n0.000000 -0.000000 5.164569\nY Mg\n2 6\ndirect\n0.666668 0.333334 0.250000 Y\n0.333333 0.666667 0.750000 Y\n0.163411 0.326823 0.250000 Mg\n0.163411 0.836588 0.250000 Mg\n0.673175 0.836588 0.250000 Mg\n0.326823 0.163413 0.750000 Mg\n0.836589 0.163413 0.750000 Mg\n0.836588 0.673177 0.750000 Mg\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Y",
"Mg"
],
"chemical_system": "Mg-Y",
"density": 2.7005941824626785,
"density_atomic": 0.040200896999484655,
"volume": 199.00053474186294,
"volume_molar": 14.980115394134613,
"formula_full": "Y2 Mg6",
"formula_reduced": "YMg3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.4480425642857143,
"spacegroup": 194
},
{
"id": "jvasp-16579",
"created_at": "2022-09-04T14:38:01.702865Z",
"updated_at": "2022-09-04T14:38:01.702890Z",
"structure_string": "Mn1 Zn3\n1.0\n3.812552 -0.000000 -0.000000\n-0.000000 3.812552 -0.000000\n0.000000 -0.000000 3.812552\nMn Zn\n1 3\ndirect\n0.000000 0.000000 0.000000 Mn\n0.000000 0.500000 0.500000 Zn\n0.500000 0.500000 0.000000 Zn\n0.500000 0.000000 0.500000 Zn\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Mn",
"Zn"
],
"chemical_system": "Mn-Zn",
"density": 7.525943748505747,
"density_atomic": 0.07217929966489733,
"volume": 55.41755071842715,
"volume_molar": 8.343307275020186,
"formula_full": "Mn1 Zn3",
"formula_reduced": "MnZn3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 221
},
{
"id": "jvasp-37388",
"created_at": "2022-09-04T14:38:01.708615Z",
"updated_at": "2022-09-04T14:38:01.708651Z",
"structure_string": "Ti2 Ag1\n1.0\n-1.453752 1.453752 6.068108\n1.453752 -1.453752 6.068108\n1.453752 1.453752 -6.068108\nTi Ag\n2 1\ndirect\n0.327577 0.327577 0.000000 Ti\n0.672423 0.672423 0.000000 Ti\n0.000000 0.000000 0.000000 Ag\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Ti",
"Ag"
],
"chemical_system": "Ag-Ti",
"density": 6.590792219878165,
"density_atomic": 0.058482686063906136,
"volume": 51.297233453364164,
"volume_molar": 10.29730534849133,
"formula_full": "Ti2 Ag1",
"formula_reduced": "Ti2Ag",
"formula_anonymous": "AB2",
"energy_above_hull": 2.1625179755555566,
"spacegroup": 139
},
{
"id": "jvasp-37608",
"created_at": "2022-09-04T14:38:01.754905Z",
"updated_at": "2022-09-04T14:38:01.754930Z",
"structure_string": "Ti3 Ni1\n1.0\n3.921685 -0.000000 0.000000\n0.000000 3.921685 0.000000\n0.000000 0.000000 3.921685\nTi Ni\n3 1\ndirect\n0.000000 0.499999 0.499999 Ti\n0.499999 0.000000 0.499999 Ti\n0.499999 0.499999 0.000000 Ti\n0.000000 0.000000 0.000000 Ni\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ti",
"Ni"
],
"chemical_system": "Ni-Ti",
"density": 5.569482412906523,
"density_atomic": 0.06631959572278481,
"volume": 60.3139985460701,
"volume_molar": 9.08048472607174,
"formula_full": "Ti3 Ni1",
"formula_reduced": "Ti3Ni",
"formula_anonymous": "AB3",
"energy_above_hull": 3.10010185,
"spacegroup": 221
},
{
"id": "jvasp-109495",
"created_at": "2022-09-04T14:38:01.775822Z",
"updated_at": "2022-09-04T14:38:01.775850Z",
"structure_string": "Y2 O4\n1.0\n4.583272 -0.214188 0.332644\n-1.320139 4.394257 0.332644\n-0.318597 -0.408122 4.229569\nY O\n2 4\ndirect\n0.166506 0.833494 0.749999 Y\n0.833493 0.166506 0.249999 Y\n0.077086 0.322981 0.749892 O\n0.677018 0.922914 0.750106 O\n0.922912 0.677019 0.250106 O\n0.322980 0.077087 0.249892 O\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Y",
"O"
],
"chemical_system": "O-Y",
"density": 4.708541840266205,
"density_atomic": 0.07035834042668725,
"volume": 85.27773627992185,
"volume_molar": 8.559242192864136,
"formula_full": "Y2 O4",
"formula_reduced": "YO2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.3262741500000006,
"spacegroup": 63
}
]
}