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=1006",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=density_atomic&page=1004",
"results": [
{
"id": "jvasp-18103",
"created_at": "2022-09-04T14:37:29.405523Z",
"updated_at": "2022-09-04T14:37:29.405540Z",
"structure_string": "Pu1 In1\n1.0\n3.192199 -0.000000 0.000000\n0.000000 3.192199 -0.000000\n-0.000000 -0.000000 4.947694\nPu In\n1 1\ndirect\n0.500000 0.500000 0.500000 Pu\n0.000000 0.000000 0.000000 In\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Pu",
"In"
],
"chemical_system": "In-Pu",
"density": 11.81790711490846,
"density_atomic": 0.03966863432669419,
"volume": 50.41766710517033,
"volume_molar": 15.181114404907873,
"formula_full": "Pu1 In1",
"formula_reduced": "PuIn",
"formula_anonymous": "AB",
"energy_above_hull": 2.3852149849999997,
"spacegroup": 123
},
{
"id": "jvasp-5107",
"created_at": "2022-09-04T14:37:08.576987Z",
"updated_at": "2022-09-04T14:37:08.577005Z",
"structure_string": "Pu1 In1\n1.0\n3.192572 0.000000 -0.000000\n-0.000000 3.192572 0.000000\n-0.000000 0.000000 4.946517\nPu In\n1 1\ndirect\n0.500000 0.500000 0.500000 Pu\n0.000000 0.000000 0.000000 In\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Pu",
"In"
],
"chemical_system": "In-Pu",
"density": 11.817957173879503,
"density_atomic": 0.039668802357378276,
"volume": 50.41745354401924,
"volume_molar": 15.181050100142235,
"formula_full": "Pu1 In1",
"formula_reduced": "PuIn",
"formula_anonymous": "AB",
"energy_above_hull": 2.3852149849999997,
"spacegroup": 123
},
{
"id": "jvasp-107437",
"created_at": "2022-09-04T14:37:01.691532Z",
"updated_at": "2022-09-04T14:37:01.691551Z",
"structure_string": "Dy1 Tm1 Cd2\n1.0\n4.524402 -0.000000 2.612165\n1.508134 4.265648 2.612165\n-0.000000 -0.000000 5.224330\nDy Tm Cd\n1 1 2\ndirect\n0.499999 0.500000 0.499999 Dy\n0.000000 0.000000 0.000000 Tm\n0.749999 0.750000 0.749999 Cd\n0.250000 0.250000 0.250000 Cd\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Dy",
"Tm",
"Cd"
],
"chemical_system": "Cd-Dy-Tm",
"density": 9.161090378836164,
"density_atomic": 0.039671917223538744,
"volume": 100.82698997029212,
"volume_molar": 15.179858150205183,
"formula_full": "Dy1 Tm1 Cd2",
"formula_reduced": "DyTmCd2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-22728",
"created_at": "2022-09-04T14:36:11.690374Z",
"updated_at": "2022-09-04T14:36:11.690396Z",
"structure_string": "Ca2 Sn1 S4\n1.0\n0.000000 0.000000 -3.868185\n-6.939795 0.050151 0.000000\n2.275465 6.556335 0.000000\nCa Sn S\n2 1 4\ndirect\n0.500001 -0.000000 0.500000 Ca\n0.500001 0.500000 -0.000000 Ca\n0.000000 0.000000 0.000000 Sn\n0.000000 0.232242 0.767758 S\n0.000000 0.767757 0.232242 S\n0.500001 0.777293 0.777294 S\n0.500001 0.222706 0.222706 S\n",
"nsites": 7,
"nelements": 3,
"elements": [
"Ca",
"Sn",
"S"
],
"chemical_system": "Ca-S-Sn",
"density": 3.0786566989401662,
"density_atomic": 0.03967300917505543,
"volume": 176.44237595169056,
"volume_molar": 15.179440342998852,
"formula_full": "Ca2 Sn1 S4",
"formula_reduced": "Ca2SnS4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 0.9444303628571428,
"spacegroup": 65
},
{
"id": "jvasp-109779",
"created_at": "2022-09-04T14:38:27.867982Z",
"updated_at": "2022-09-04T14:38:27.868010Z",
"structure_string": "Cd1 Ag2 Sn1 S4\n1.0\n4.075417 0.000000 0.000000\n0.000000 6.823322 0.045204\n0.000000 0.032710 7.251589\nCd Ag Sn S\n1 2 1 4\ndirect\n-0.000000 0.110470 0.173996 Cd\n0.500000 0.135978 0.669687 Ag\n0.500000 0.647648 0.311895 Ag\n-0.000000 0.635238 0.843079 Sn\n0.500000 0.510375 0.665034 S\n-0.000000 0.495155 0.151433 S\n0.500000 0.010118 0.347591 S\n-0.000000 0.990215 0.837282 S\n",
"nsites": 8,
"nelements": 4,
"elements": [
"Cd",
"Ag",
"Sn",
"S"
],
"chemical_system": "Ag-Cd-S-Sn",
"density": 4.736063124392823,
"density_atomic": 0.03967362321946135,
"volume": 201.64530866633098,
"volume_molar": 15.179205404778664,
"formula_full": "Cd1 Ag2 Sn1 S4",
"formula_reduced": "CdAg2SnS4",
"formula_anonymous": "ABC2D4",
"energy_above_hull": 0.7681644962499999,
"spacegroup": 6
},
{
"id": "jvasp-12141",
"created_at": "2022-09-04T14:37:08.816400Z",
"updated_at": "2022-09-04T14:37:08.816410Z",
"structure_string": "Ba2 B4 Se12\n1.0\n6.881898 0.020106 -0.000000\n-2.544468 6.394264 -0.000000\n0.000000 0.000000 10.297987\nBa B Se\n2 4 12\ndirect\n0.500000 0.500000 0.500000 Ba\n0.000000 0.000000 0.000000 Ba\n0.613824 0.386176 0.000000 B\n0.386176 0.613824 0.000000 B\n0.886176 0.113825 0.500000 B\n0.113824 0.886175 0.500000 B\n0.600905 0.600905 0.859808 Se\n0.100905 0.100905 0.640193 Se\n0.107375 0.524109 0.904255 Se\n0.607375 0.024109 0.595746 Se\n0.475891 0.892625 0.095745 Se\n0.524109 0.107375 0.904255 Se\n0.975891 0.392625 0.404255 Se\n0.899095 0.899095 0.359807 Se\n0.399095 0.399095 0.140193 Se\n0.892625 0.475891 0.095745 Se\n0.024109 0.607375 0.595746 Se\n0.392625 0.975891 0.404255 Se\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Ba",
"B",
"Se"
],
"chemical_system": "B-Ba-Se",
"density": 4.631560714777627,
"density_atomic": 0.03967498410053331,
"volume": 453.68638218957835,
"volume_molar": 15.178684746893321,
"formula_full": "Ba2 B4 Se12",
"formula_reduced": "Ba(BSe3)2",
"formula_anonymous": "AB2C6",
"energy_above_hull": 2.176869037407408,
"spacegroup": 64
},
{
"id": "jvasp-100360",
"created_at": "2022-09-04T14:36:34.002548Z",
"updated_at": "2022-09-04T14:36:34.002573Z",
"structure_string": "Nd2 Zn2 Sn2\n1.0\n4.850347 -0.000000 -0.000000\n-2.425172 4.200523 0.000000\n0.000000 0.000000 7.422233\nNd Zn Sn\n2 2 2\ndirect\n-0.000000 -0.000000 0.232318 Nd\n-0.000000 -0.000000 0.767682 Nd\n0.333333 0.666667 0.003799 Zn\n0.666667 0.333333 0.996201 Zn\n0.666667 0.333333 0.539243 Sn\n0.333333 0.666667 0.460757 Sn\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Nd",
"Zn",
"Sn"
],
"chemical_system": "Nd-Sn-Zn",
"density": 7.211405260048516,
"density_atomic": 0.039677151886269434,
"volume": 151.2205315844846,
"volume_molar": 15.177855450063202,
"formula_full": "Nd2 Zn2 Sn2",
"formula_reduced": "NdZnSn",
"formula_anonymous": "ABC",
"energy_above_hull": 0.3576214199999999,
"spacegroup": 164
},
{
"id": "jvasp-23532",
"created_at": "2022-09-04T14:37:33.835011Z",
"updated_at": "2022-09-04T14:37:33.835030Z",
"structure_string": "Sr2 In8 Pt2\n1.0\n4.454408 0.000000 -1.189304\n0.000000 7.604429 0.000000\n-0.001960 -0.000000 8.929061\nSr In Pt\n2 8 2\ndirect\n0.873252 0.250000 0.746504 Sr\n0.126748 0.750000 0.253496 Sr\n0.683577 0.048544 0.367154 In\n0.500000 0.500000 0.000000 In\n0.316423 0.548544 0.632847 In\n0.316423 0.951456 0.632847 In\n0.683577 0.451456 0.367154 In\n0.933742 0.750000 0.867484 In\n0.066258 0.250000 0.132517 In\n0.500000 0.000000 0.000000 In\n0.224239 0.250000 0.448479 Pt\n0.775761 0.750000 0.551521 Pt\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Sr",
"In",
"Pt"
],
"chemical_system": "In-Pt-Sr",
"density": 8.14764337816217,
"density_atomic": 0.039677500595057584,
"volume": 302.43840514225275,
"volume_molar": 15.177722058304616,
"formula_full": "Sr2 In8 Pt2",
"formula_reduced": "SrIn4Pt",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.0,
"spacegroup": 63
},
{
"id": "jvasp-37167",
"created_at": "2022-09-04T14:38:08.884117Z",
"updated_at": "2022-09-04T14:38:08.884148Z",
"structure_string": "Na1 Ho1 Se2\n1.0\n-2.052247 -3.554595 0.000000\n-4.104493 0.000000 -0.000000\n-2.052247 -1.184865 -6.909191\nNa Ho Se\n1 1 2\ndirect\n0.500001 0.500000 0.500000 Na\n0.000000 0.000000 0.000000 Ho\n0.743807 0.743805 0.768584 Se\n0.256195 0.256195 0.231416 Se\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Na",
"Ho",
"Se"
],
"chemical_system": "Ho-Na-Se",
"density": 5.697017958588183,
"density_atomic": 0.039681049287429895,
"volume": 100.80378598423592,
"volume_molar": 15.176364708449597,
"formula_full": "Na1 Ho1 Se2",
"formula_reduced": "NaHoSe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.420075325,
"spacegroup": 166
},
{
"id": "jvasp-91560",
"created_at": "2022-09-04T14:36:19.815288Z",
"updated_at": "2022-09-04T14:36:19.815325Z",
"structure_string": "Tl6 Pt2\n1.0\n5.863660 -0.000000 0.000000\n0.000000 5.863660 0.000000\n0.000000 0.000000 5.863660\nTl Pt\n6 2\ndirect\n0.000000 0.500000 0.750000 Tl\n0.500000 0.250000 0.000000 Tl\n0.750000 0.000000 0.500000 Tl\n0.000000 0.500000 0.250000 Tl\n0.500000 0.750000 0.000000 Tl\n0.250000 0.000000 0.500000 Tl\n0.500000 0.500000 0.500000 Pt\n0.000000 0.000000 0.000000 Pt\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Tl",
"Pt"
],
"chemical_system": "Pt-Tl",
"density": 13.314038700767187,
"density_atomic": 0.039681094875043316,
"volume": 201.6073403516759,
"volume_molar": 15.176347273087753,
"formula_full": "Tl6 Pt2",
"formula_reduced": "Tl3Pt",
"formula_anonymous": "AB3",
"energy_above_hull": 0.2134973,
"spacegroup": 223
},
{
"id": "jvasp-109968",
"created_at": "2022-09-04T14:38:27.203806Z",
"updated_at": "2022-09-04T14:38:27.203829Z",
"structure_string": "Ho3 Ga1\n1.0\n4.653978 -0.000000 0.000000\n0.000000 4.653978 0.000000\n-0.000000 -0.000000 4.653978\nHo Ga\n3 1\ndirect\n0.500000 0.500000 -0.000000 Ho\n0.500000 0.000000 0.500000 Ho\n-0.000000 0.500000 0.500000 Ho\n0.000000 0.000000 0.000000 Ga\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ho",
"Ga"
],
"chemical_system": "Ga-Ho",
"density": 9.299311716517554,
"density_atomic": 0.03968140249168608,
"volume": 100.80288872950162,
"volume_molar": 15.176229623591908,
"formula_full": "Ho3 Ga1",
"formula_reduced": "Ho3Ga",
"formula_anonymous": "AB3",
"energy_above_hull": 0.908172877777778,
"spacegroup": 221
},
{
"id": "jvasp-111702",
"created_at": "2022-09-04T14:38:41.545070Z",
"updated_at": "2022-09-04T14:38:41.545097Z",
"structure_string": "Ba4 Er8 S16\n1.0\n4.005420 -0.000000 0.000000\n0.000000 12.216635 0.000000\n0.000000 0.000000 14.419763\nBa Er S\n4 8 16\ndirect\n0.250000 0.241878 0.337532 Ba\n0.250000 0.741878 0.162468 Ba\n0.750000 0.758121 0.662468 Ba\n0.750000 0.258122 0.837532 Ba\n0.750000 0.933520 0.891684 Er\n0.750000 0.433520 0.608316 Er\n0.250000 0.566480 0.391684 Er\n0.250000 0.066480 0.108316 Er\n0.750000 0.921252 0.398674 Er\n0.250000 0.578748 0.898674 Er\n0.250000 0.078748 0.601326 Er\n0.750000 0.421252 0.101326 Er\n0.250000 0.376595 0.976880 S\n0.250000 0.977148 0.282896 S\n0.250000 0.477149 0.217104 S\n0.750000 0.123405 0.476881 S\n0.750000 0.623405 0.023119 S\n0.250000 0.876594 0.523119 S\n0.750000 0.207118 0.160526 S\n0.250000 0.581460 0.576686 S\n0.250000 0.792881 0.839474 S\n0.250000 0.292882 0.660526 S\n0.750000 0.418540 0.423313 S\n0.750000 0.918540 0.076686 S\n0.750000 0.522851 0.782896 S\n0.250000 0.081460 0.923313 S\n0.750000 0.707118 0.339474 S\n0.750000 0.022851 0.717104 S\n",
"nsites": 28,
"nelements": 3,
"elements": [
"Ba",
"Er",
"S"
],
"chemical_system": "Ba-Er-S",
"density": 5.649090743580689,
"density_atomic": 0.039682611784485546,
"volume": 705.5987179489778,
"volume_molar": 15.175767141301009,
"formula_full": "Ba4 Er8 S16",
"formula_reduced": "Ba(ErS2)2",
"formula_anonymous": "AB2C4",
"energy_above_hull": 1.30832371,
"spacegroup": 62
}
]
}