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=4626",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-energy_above_hull&page=4624",
"results": [
{
"id": "jvasp-41413",
"created_at": "2022-09-04T14:38:02.639871Z",
"updated_at": "2022-09-04T14:38:02.639891Z",
"structure_string": "Tm1 Mg1 Cd2\n1.0\n0.000000 3.551685 3.551685\n3.551685 0.000000 3.551685\n3.551685 3.551685 0.000000\nTm Mg Cd\n1 1 2\ndirect\n0.749999 0.749999 0.749999 Tm\n0.250001 0.250001 0.250001 Mg\n0.499999 0.499999 0.499999 Cd\n0.000000 0.000000 0.000000 Cd\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Tm",
"Mg",
"Cd"
],
"chemical_system": "Cd-Mg-Tm",
"density": 7.747394156268828,
"density_atomic": 0.04464025557250394,
"volume": 89.60522176006069,
"volume_molar": 13.490381456752512,
"formula_full": "Tm1 Mg1 Cd2",
"formula_reduced": "TmMgCd2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-38516",
"created_at": "2022-09-04T14:37:58.075069Z",
"updated_at": "2022-09-04T14:37:58.075098Z",
"structure_string": "Na1 Ca1 Tl2\n1.0\n-0.000000 3.808810 3.808810\n3.808810 0.000000 3.808810\n3.808810 3.808810 0.000000\nNa Ca Tl\n1 1 2\ndirect\n0.750000 0.750000 0.750000 Na\n0.250000 0.250000 0.250000 Ca\n0.499999 0.499999 0.499999 Tl\n0.000000 0.000000 0.000000 Tl\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Na",
"Ca",
"Tl"
],
"chemical_system": "Ca-Na-Tl",
"density": 7.089910423677512,
"density_atomic": 0.03619612418407351,
"volume": 110.50906941467566,
"volume_molar": 16.63752928179469,
"formula_full": "Na1 Ca1 Tl2",
"formula_reduced": "NaCaTl2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-36961",
"created_at": "2022-09-04T14:38:02.575399Z",
"updated_at": "2022-09-04T14:38:02.575422Z",
"structure_string": "K2 Ca2 Br6\n1.0\n0.000000 4.237788 0.002229\n10.722316 0.000000 0.000000\n0.000000 -2.114511 -6.971722\nK Ca Br\n2 2 6\ndirect\n0.747914 0.750000 0.495575 K\n0.252087 0.250000 0.504424 K\n0.000000 0.500000 0.000000 Ca\n0.000000 0.000000 0.000000 Ca\n0.636360 0.443633 0.272787 Br\n0.363641 0.943633 0.727212 Br\n0.636360 0.056367 0.272787 Br\n0.363641 0.556367 0.727212 Br\n0.071128 0.750000 0.141995 Br\n0.928873 0.250000 0.858005 Br\n",
"nsites": 10,
"nelements": 3,
"elements": [
"K",
"Ca",
"Br"
],
"chemical_system": "Br-Ca-K",
"density": 3.343636645958975,
"density_atomic": 0.03157194939296574,
"volume": 316.73685636364314,
"volume_molar": 19.074339329017608,
"formula_full": "K2 Ca2 Br6",
"formula_reduced": "KCaBr3",
"formula_anonymous": "ABC3",
"energy_above_hull": 0.0,
"spacegroup": 63
},
{
"id": "jvasp-92199",
"created_at": "2022-09-04T14:37:41.280447Z",
"updated_at": "2022-09-04T14:37:41.280465Z",
"structure_string": "K1 Mg6 Ti1\n1.0\n6.600542 0.000992 0.000000\n-3.299413 5.716733 0.000000\n0.000000 0.000000 5.154630\nK Mg Ti\n1 6 1\ndirect\n0.416654 0.083345 0.750000 K\n0.064629 0.907242 0.250000 Mg\n0.592757 0.435371 0.250000 Mg\n0.592668 0.907331 0.250000 Mg\n0.397148 0.573576 0.750000 Mg\n0.926424 0.102852 0.750000 Mg\n0.926389 0.573610 0.750000 Mg\n0.083332 0.416668 0.250000 Ti\n",
"nsites": 8,
"nelements": 3,
"elements": [
"K",
"Mg",
"Ti"
],
"chemical_system": "K-Mg-Ti",
"density": 1.9872871819112805,
"density_atomic": 0.041127026685329984,
"volume": 194.51928925495605,
"volume_molar": 14.64278175535626,
"formula_full": "K1 Mg6 Ti1",
"formula_reduced": "KMg6Ti",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.0,
"spacegroup": 187
},
{
"id": "jvasp-37249",
"created_at": "2022-09-04T14:38:02.571724Z",
"updated_at": "2022-09-04T14:38:02.571746Z",
"structure_string": "Sm1 Ho1 Zn2\n1.0\n0.000000 3.574451 3.574451\n3.574451 -0.000000 3.574451\n3.574451 3.574451 -0.000000\nSm Ho Zn\n1 1 2\ndirect\n0.750000 0.750000 0.750000 Sm\n0.250001 0.250001 0.250001 Ho\n0.000000 0.000000 0.000000 Zn\n0.500000 0.500000 0.500000 Zn\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sm",
"Ho",
"Zn"
],
"chemical_system": "Ho-Sm-Zn",
"density": 8.11019657749365,
"density_atomic": 0.0437927231644685,
"volume": 91.3393758359705,
"volume_molar": 13.751464455368925,
"formula_full": "Sm1 Ho1 Zn2",
"formula_reduced": "SmHoZn2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-40047",
"created_at": "2022-09-04T14:37:52.168282Z",
"updated_at": "2022-09-04T14:37:52.168296Z",
"structure_string": "K1 Tl2 Bi1\n1.0\n0.000001 4.043611 4.043615\n4.043619 0.000001 4.043615\n4.043618 4.043610 0.000002\nK Tl Bi\n1 2 1\ndirect\n0.749999 0.749999 0.750001 K\n0.000000 0.000000 0.000000 Tl\n0.499999 0.500000 0.500001 Tl\n0.249999 0.249999 0.249999 Bi\n",
"nsites": 4,
"nelements": 3,
"elements": [
"K",
"Tl",
"Bi"
],
"chemical_system": "Bi-K-Tl",
"density": 8.248464772736028,
"density_atomic": 0.030249689497654227,
"volume": 132.2327622672024,
"volume_molar": 19.908107686417736,
"formula_full": "K1 Tl2 Bi1",
"formula_reduced": "KTl2Bi",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-36995",
"created_at": "2022-09-04T14:38:02.551629Z",
"updated_at": "2022-09-04T14:38:02.551648Z",
"structure_string": "Tl1 Ni1 F3\n1.0\n4.113541 -0.000670 -0.000045\n0.000834 4.113571 -0.001152\n0.000053 0.001444 4.113601\nTl Ni F\n1 1 3\ndirect\n0.000020 0.998032 0.987956 Tl\n0.500010 0.498097 0.487944 Ni\n-0.000002 0.497885 0.488031 F\n0.500005 0.497972 0.987996 F\n0.499959 0.998012 0.488065 F\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Tl",
"Ni",
"F"
],
"chemical_system": "F-Ni-Tl",
"density": 7.635537395977643,
"density_atomic": 0.07183117232964407,
"volume": 69.60766249302247,
"volume_molar": 8.383742830151078,
"formula_full": "Tl1 Ni1 F3",
"formula_reduced": "TlNiF3",
"formula_anonymous": "ABC3",
"energy_above_hull": 0.0,
"spacegroup": 221
},
{
"id": "jvasp-40616",
"created_at": "2022-09-04T14:37:46.769340Z",
"updated_at": "2022-09-04T14:37:46.769362Z",
"structure_string": "Ba2 Sn1 Hg1\n1.0\n0.000000 4.210538 4.210538\n4.210538 0.000000 4.210538\n4.210538 4.210538 -0.000000\nBa Sn Hg\n2 1 1\ndirect\n0.500001 0.500001 0.500001 Ba\n0.000000 0.000000 0.000000 Ba\n0.749999 0.749999 0.749999 Sn\n0.250001 0.250001 0.250001 Hg\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"Sn",
"Hg"
],
"chemical_system": "Ba-Hg-Sn",
"density": 6.606312899378162,
"density_atomic": 0.02679274569977309,
"volume": 149.29414270646686,
"volume_molar": 22.47675855054677,
"formula_full": "Ba2 Sn1 Hg1",
"formula_reduced": "Ba2SnHg",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-40086",
"created_at": "2022-09-04T14:37:47.224790Z",
"updated_at": "2022-09-04T14:37:47.224820Z",
"structure_string": "Yb2 Ag1 Sn1\n1.0\n0.000000 3.686645 3.686645\n3.686645 0.000000 3.686645\n3.686645 3.686645 -0.000000\nYb Ag Sn\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Yb\n0.500002 0.500002 0.500002 Yb\n0.250000 0.250000 0.250000 Ag\n0.750001 0.750001 0.750001 Sn\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Yb",
"Ag",
"Sn"
],
"chemical_system": "Ag-Sn-Yb",
"density": 9.48900391920858,
"density_atomic": 0.039914991031937394,
"volume": 100.21297503986557,
"volume_molar": 15.087416041710927,
"formula_full": "Yb2 Ag1 Sn1",
"formula_reduced": "Yb2AgSn",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-35212",
"created_at": "2022-09-04T14:37:58.261115Z",
"updated_at": "2022-09-04T14:37:58.261141Z",
"structure_string": "K1 Li1 I1 Cl1\n1.0\n4.263189 0.000000 -0.000000\n0.000000 4.263189 0.000000\n0.000000 0.000000 6.699364\nK Li I Cl\n1 1 1 1\ndirect\n0.500000 0.500000 0.500000 K\n0.000000 0.000000 0.000000 Li\n0.500000 0.500000 0.000000 I\n0.000000 0.000000 0.500000 Cl\n",
"nsites": 4,
"nelements": 4,
"elements": [
"K",
"Li",
"I",
"Cl"
],
"chemical_system": "Cl-I-K-Li",
"density": 2.8420867662836446,
"density_atomic": 0.03285165420674814,
"volume": 121.75946985276467,
"volume_molar": 18.331316657908133,
"formula_full": "K1 Li1 I1 Cl1",
"formula_reduced": "KLiICl",
"formula_anonymous": "ABCD",
"energy_above_hull": 0.0,
"spacegroup": 123
},
{
"id": "jvasp-14049",
"created_at": "2022-09-04T14:37:47.238694Z",
"updated_at": "2022-09-04T14:37:47.238713Z",
"structure_string": "K4 Au4 Br16\n1.0\n0.000000 9.008377 0.088589\n6.634136 0.000000 0.000000\n0.000000 -1.778084 -12.749241\nK Au Br\n4 4 16\ndirect\n0.203796 0.557674 0.181318 K\n0.203796 0.942327 0.681318 K\n0.796205 0.442326 0.818682 K\n0.796205 0.057674 0.318682 K\n0.500000 0.500000 0.500000 Au\n0.500000 0.000000 -0.000000 Au\n0.000000 0.500000 0.500000 Au\n0.000000 0.000000 0.000000 Au\n0.493955 0.340413 0.325796 Br\n0.506045 0.840413 0.174204 Br\n0.096561 0.442578 0.688232 Br\n0.903440 0.942579 0.811768 Br\n0.903440 0.557422 0.311768 Br\n0.096561 0.057422 0.188232 Br\n0.856870 0.798191 0.544656 Br\n0.333768 0.726418 0.921343 Br\n0.143131 0.201810 0.455344 Br\n0.856870 0.701810 0.044656 Br\n0.493955 0.159587 0.825796 Br\n0.333768 0.773583 0.421343 Br\n0.666232 0.273583 0.078657 Br\n0.666232 0.226417 0.578657 Br\n0.143131 0.298191 0.955344 Br\n0.506046 0.659588 0.674204 Br\n",
"nsites": 24,
"nelements": 3,
"elements": [
"K",
"Au",
"Br"
],
"chemical_system": "Au-Br-K",
"density": 4.850821914546226,
"density_atomic": 0.031542204179628025,
"volume": 760.8853161726959,
"volume_molar": 19.092326984204494,
"formula_full": "K4 Au4 Br16",
"formula_reduced": "KAuBr4",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.0,
"spacegroup": 14
},
{
"id": "jvasp-36960",
"created_at": "2022-09-04T14:37:58.338334Z",
"updated_at": "2022-09-04T14:37:58.338359Z",
"structure_string": "Rb4 Ca4 I12\n1.0\n4.637942 -0.000000 0.000000\n-0.000000 10.354578 0.000000\n0.000000 0.000000 17.060312\nRb Ca I\n4 4 12\ndirect\n0.750000 0.071631 0.323689 Rb\n0.250000 0.928369 0.676311 Rb\n0.750000 0.571632 0.176311 Rb\n0.250000 0.428369 0.823689 Rb\n0.250000 0.167056 0.056142 Ca\n0.750000 0.832944 0.943858 Ca\n0.250000 0.667056 0.443858 Ca\n0.750000 0.332944 0.556142 Ca\n0.750000 0.704570 0.783735 I\n0.250000 0.295431 0.216265 I\n0.750000 0.476344 0.392740 I\n0.250000 0.523656 0.607260 I\n0.750000 0.976344 0.107260 I\n0.250000 0.662510 0.010649 I\n0.250000 0.162510 0.489351 I\n0.750000 0.837490 0.510648 I\n0.250000 0.795431 0.283735 I\n0.750000 0.337490 0.989351 I\n0.250000 0.023656 0.892740 I\n0.750000 0.204569 0.716265 I\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Rb",
"Ca",
"I"
],
"chemical_system": "Ca-I-Rb",
"density": 4.104283383818749,
"density_atomic": 0.024410985298249813,
"volume": 819.3032667728464,
"volume_molar": 24.669797988169563,
"formula_full": "Rb4 Ca4 I12",
"formula_reduced": "RbCaI3",
"formula_anonymous": "ABC3",
"energy_above_hull": 0.0,
"spacegroup": 62
}
]
}