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=-volume_molar&page=340",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-volume_molar&page=338",
"results": [
{
"id": "jvasp-36124",
"created_at": "2022-09-04T14:37:39.155242Z",
"updated_at": "2022-09-04T14:37:39.155280Z",
"structure_string": "Ho1 Tl1 Te2\n1.0\n-2.206222 -3.821287 -0.000000\n-4.412444 0.000000 0.000000\n-2.206222 -1.273762 -8.134654\nHo Tl Te\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Ho\n0.500000 0.499999 0.500000 Tl\n0.737770 0.737769 0.786689 Te\n0.262230 0.262229 0.213310 Te\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ho",
"Tl",
"Te"
],
"chemical_system": "Ho-Te-Tl",
"density": 7.560718399098293,
"density_atomic": 0.029162989567354233,
"volume": 137.16014919395295,
"volume_molar": 20.649943127714632,
"formula_full": "Ho1 Tl1 Te2",
"formula_reduced": "HoTlTe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.375968425,
"spacegroup": 166
},
{
"id": "jvasp-65564",
"created_at": "2022-09-04T14:35:46.666692Z",
"updated_at": "2022-09-04T14:35:46.666714Z",
"structure_string": "Ba2 La1 Mo1\n1.0\n0.000000 4.093056 4.093056\n4.093056 -0.000000 4.093056\n4.093056 4.093056 0.000000\nBa La Mo\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Ba\n0.750001 0.750001 0.750001 Ba\n0.000000 0.000000 0.000000 La\n0.500000 0.500000 0.500000 Mo\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"La",
"Mo"
],
"chemical_system": "Ba-La-Mo",
"density": 6.169071142979799,
"density_atomic": 0.02916667590984307,
"volume": 137.1428136810782,
"volume_molar": 20.647333205247666,
"formula_full": "Ba2 La1 Mo1",
"formula_reduced": "Ba2LaMo",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.08006071,
"spacegroup": 225
},
{
"id": "jvasp-113657",
"created_at": "2022-09-04T14:38:48.095141Z",
"updated_at": "2022-09-04T14:38:48.095163Z",
"structure_string": "K1 Zn1\n1.0\n3.369300 -1.861223 -0.277971\n3.703029 -8.864144 -1.033822\n1.671391 -4.437697 -3.497895\nK Zn\n1 1\ndirect\n0.163979 0.884663 0.156687 K\n0.664051 0.384615 0.156732 Zn\n",
"nsites": 2,
"nelements": 2,
"elements": [
"K",
"Zn"
],
"chemical_system": "K-Zn",
"density": 2.530897486367875,
"density_atomic": 0.029168145990384652,
"volume": 68.56795082756733,
"volume_molar": 20.64629257541845,
"formula_full": "K1 Zn1",
"formula_reduced": "KZn",
"formula_anonymous": "AB",
"energy_above_hull": 0.0,
"spacegroup": 47
},
{
"id": "jvasp-103434",
"created_at": "2022-09-04T14:36:38.032219Z",
"updated_at": "2022-09-04T14:36:38.032242Z",
"structure_string": "Pr2 Y1\n1.0\n3.560787 -0.009177 8.449397\n1.700248 3.128649 8.449397\n-0.015477 -0.009177 9.169039\nPr Y\n2 1\ndirect\n0.775604 0.775602 0.775604 Pr\n0.224397 0.224397 0.224397 Pr\n0.000000 0.000000 0.000000 Y\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Pr",
"Y"
],
"chemical_system": "Pr-Y",
"density": 5.985681940122176,
"density_atomic": 0.029170134372260053,
"volume": 102.84491534097671,
"volume_molar": 20.64488522112151,
"formula_full": "Pr2 Y1",
"formula_reduced": "Pr2Y",
"formula_anonymous": "AB2",
"energy_above_hull": 1.8689183833333332,
"spacegroup": 166
},
{
"id": "jvasp-100263",
"created_at": "2022-09-04T14:36:33.349826Z",
"updated_at": "2022-09-04T14:36:33.349845Z",
"structure_string": "Yb6 Er2\n1.0\n7.290542 0.000000 -0.000000\n-3.645271 6.313795 -0.000000\n0.000000 -0.000000 5.956287\nYb Er\n6 2\ndirect\n0.170119 0.340238 0.250000 Yb\n0.659761 0.829880 0.250000 Yb\n0.170119 0.829880 0.250000 Yb\n0.829880 0.659761 0.750000 Yb\n0.340239 0.170119 0.750000 Yb\n0.829880 0.170119 0.750000 Yb\n0.333333 0.666667 0.750000 Er\n0.666667 0.333333 0.250000 Er\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Yb",
"Er"
],
"chemical_system": "Er-Yb",
"density": 8.31413691174414,
"density_atomic": 0.02917857498422163,
"volume": 274.17377319920575,
"volume_molar": 20.63891318632416,
"formula_full": "Yb6 Er2",
"formula_reduced": "Yb3Er",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 194
},
{
"id": "jvasp-102873",
"created_at": "2022-09-04T14:36:45.922357Z",
"updated_at": "2022-09-04T14:36:45.922379Z",
"structure_string": "K2 Al1 In1 Br6\n1.0\n6.802684 -0.000000 3.927531\n2.267561 6.413632 3.927531\n-0.000000 -0.000000 7.855063\nK Al In Br\n2 1 1 6\ndirect\n0.749999 0.750000 0.750000 K\n0.250000 0.250000 0.250000 K\n0.000000 0.000000 0.000000 Al\n0.500000 0.500000 0.500000 In\n0.773739 0.226261 0.226261 Br\n0.226261 0.226261 0.773739 Br\n0.226261 0.773739 0.773739 Br\n0.226261 0.773739 0.226261 Br\n0.773739 0.226261 0.773739 Br\n0.773738 0.773739 0.226261 Br\n",
"nsites": 10,
"nelements": 4,
"elements": [
"K",
"Al",
"In",
"Br"
],
"chemical_system": "Al-Br-In-K",
"density": 3.388856841164841,
"density_atomic": 0.029178703605656036,
"volume": 342.7157057814449,
"volume_molar": 20.63882220878607,
"formula_full": "K2 Al1 In1 Br6",
"formula_reduced": "K2AlInBr6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-54593",
"created_at": "2022-09-04T14:38:36.788773Z",
"updated_at": "2022-09-04T14:38:36.788800Z",
"structure_string": "K8 Rb4 Bi4 Se12\n1.0\n9.863491 0.000000 0.000000\n0.000000 9.863491 0.000000\n-0.000000 -0.000000 9.863491\nK Rb Bi Se\n8 4 4 12\ndirect\n0.178953 0.678953 0.821047 K\n0.678953 0.821047 0.178953 K\n0.821047 0.178953 0.678953 K\n0.321047 0.321047 0.321047 K\n0.685693 0.185693 0.314307 K\n0.185693 0.314307 0.685693 K\n0.314307 0.685693 0.185693 K\n0.814307 0.814307 0.814307 K\n0.928810 0.428810 0.071190 Rb\n0.428810 0.071190 0.928810 Rb\n0.071190 0.928810 0.428810 Rb\n0.571190 0.571190 0.571190 Rb\n0.035814 0.035814 0.035814 Bi\n0.535814 0.464186 0.964186 Bi\n0.964186 0.535814 0.464186 Bi\n0.464186 0.964186 0.535814 Bi\n0.001655 0.773066 0.108013 Se\n0.891987 0.501655 0.726934 Se\n0.273066 0.391987 0.998345 Se\n0.501655 0.726934 0.891987 Se\n0.391987 0.998345 0.273066 Se\n0.773066 0.108013 0.001655 Se\n0.998345 0.273066 0.391987 Se\n0.108013 0.001655 0.773066 Se\n0.726934 0.891987 0.501655 Se\n0.498345 0.226934 0.608013 Se\n0.608013 0.498345 0.226934 Se\n0.226934 0.608013 0.498345 Se\n",
"nsites": 28,
"nelements": 4,
"elements": [
"K",
"Rb",
"Bi",
"Se"
],
"chemical_system": "Bi-K-Rb-Se",
"density": 4.218990150711366,
"density_atomic": 0.029178709041850943,
"volume": 959.6037974072011,
"volume_molar": 20.638818363631028,
"formula_full": "K8 Rb4 Bi4 Se12",
"formula_reduced": "K2RbBiSe3",
"formula_anonymous": "ABC2D3",
"energy_above_hull": 0.2234329142857141,
"spacegroup": 198
},
{
"id": "jvasp-71500",
"created_at": "2022-09-04T14:35:51.167426Z",
"updated_at": "2022-09-04T14:35:51.167455Z",
"structure_string": "Na1 Sr2 Be1\n1.0\n3.934965 0.000000 -0.000000\n0.000000 3.934965 0.000000\n0.000000 0.000000 8.851824\nNa Sr Be\n1 2 1\ndirect\n0.500001 0.500001 0.686821 Na\n0.000000 0.000000 0.965814 Sr\n0.500001 0.500001 0.324990 Sr\n0.000000 0.000000 0.522374 Be\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Na",
"Sr",
"Be"
],
"chemical_system": "Be-Na-Sr",
"density": 2.510800764538213,
"density_atomic": 0.029184044130449605,
"volume": 137.0611962523227,
"volume_molar": 20.635045414136794,
"formula_full": "Na1 Sr2 Be1",
"formula_reduced": "NaSr2Be",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.171052654375,
"spacegroup": 99
},
{
"id": "jvasp-65046",
"created_at": "2022-09-04T14:36:19.497252Z",
"updated_at": "2022-09-04T14:36:19.497284Z",
"structure_string": "K1 Be1 Bi4\n1.0\n0.000000 4.684408 4.684408\n4.684408 0.000000 4.684408\n4.684408 4.684408 0.000000\nK Be Bi\n1 1 4\ndirect\n0.250000 0.250000 0.250000 K\n0.000000 0.000000 0.000000 Be\n0.121755 0.626082 0.626082 Bi\n0.626082 0.626082 0.626082 Bi\n0.626082 0.121755 0.626082 Bi\n0.626082 0.626082 0.121755 Bi\n",
"nsites": 6,
"nelements": 3,
"elements": [
"K",
"Be",
"Bi"
],
"chemical_system": "Be-Bi-K",
"density": 7.140407309699234,
"density_atomic": 0.02918482629294562,
"volume": 205.58628445392816,
"volume_molar": 20.63449238844925,
"formula_full": "K1 Be1 Bi4",
"formula_reduced": "KBeBi4",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.8940102166666665,
"spacegroup": 216
},
{
"id": "jvasp-25208",
"created_at": "2022-09-04T14:38:30.964608Z",
"updated_at": "2022-09-04T14:38:30.964623Z",
"structure_string": "Sb4\n1.0\n3.881770 -0.000000 1.332429\n1.940885 5.778871 0.666215\n0.064720 -0.000000 6.132049\nSb\n4\ndirect\n0.652164 0.195673 0.500000 Sb\n0.152165 0.500000 0.195673 Sb\n0.347837 0.804327 0.500001 Sb\n0.847836 0.500000 0.804328 Sb\n",
"nsites": 4,
"nelements": 1,
"elements": [
"Sb"
],
"chemical_system": "Sb",
"density": 5.9008087845773725,
"density_atomic": 0.029184872791433777,
"volume": 137.05730460384476,
"volume_molar": 20.63445951276373,
"formula_full": "Sb4",
"formula_reduced": "Sb",
"formula_anonymous": "A",
"energy_above_hull": 0.30864,
"spacegroup": 140
},
{
"id": "jvasp-110280",
"created_at": "2022-09-04T14:38:37.106993Z",
"updated_at": "2022-09-04T14:38:37.107001Z",
"structure_string": "Bi2 Sb2 Te3\n1.0\n4.420726 0.021311 13.577788\n2.172392 3.850193 13.577788\n0.036293 0.021311 14.279280\nBi Sb Te\n2 2 3\ndirect\n0.853592 0.853590 0.853593 Bi\n0.146408 0.146408 0.146409 Bi\n0.712737 0.712735 0.712737 Sb\n0.287264 0.287263 0.287264 Sb\n0.580585 0.580583 0.580585 Te\n0.419416 0.419415 0.419416 Te\n0.000000 0.000000 0.000000 Te\n",
"nsites": 7,
"nelements": 3,
"elements": [
"Bi",
"Sb",
"Te"
],
"chemical_system": "Bi-Sb-Te",
"density": 7.229982116504306,
"density_atomic": 0.029185616559303487,
"volume": 239.84417069882366,
"volume_molar": 20.63393366305405,
"formula_full": "Bi2 Sb2 Te3",
"formula_reduced": "Bi2Sb2Te3",
"formula_anonymous": "A2B2C3",
"energy_above_hull": 1.2502163000000002,
"spacegroup": 166
},
{
"id": "jvasp-99825",
"created_at": "2022-09-04T14:36:33.229910Z",
"updated_at": "2022-09-04T14:36:33.229935Z",
"structure_string": "Nd6 Sm2\n1.0\n7.312625 -0.000000 -0.000000\n-3.656313 6.332919 0.000000\n0.000000 0.000000 5.918783\nNd Sm\n6 2\ndirect\n0.167114 0.334226 0.250000 Nd\n0.665775 0.832887 0.250000 Nd\n0.167114 0.832887 0.250000 Nd\n0.832887 0.665774 0.750000 Nd\n0.334226 0.167113 0.750000 Nd\n0.832887 0.167113 0.750000 Nd\n0.333333 0.666667 0.750000 Sm\n0.666668 0.333333 0.250000 Sm\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Nd",
"Sm"
],
"chemical_system": "Nd-Sm",
"density": 7.064835487416422,
"density_atomic": 0.029186386753355557,
"volume": 274.10039028144655,
"volume_molar": 20.63338915807259,
"formula_full": "Nd6 Sm2",
"formula_reduced": "Nd3Sm",
"formula_anonymous": "AB3",
"energy_above_hull": 1.6153058437500003,
"spacegroup": 194
}
]
}