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&page=1274",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-density&page=1272",
"results": [
{
"id": "jvasp-86579",
"created_at": "2022-09-04T14:35:53.611665Z",
"updated_at": "2022-09-04T14:35:53.611693Z",
"structure_string": "Ba1 Bi4 Br2 O6\n1.0\n3.996942 0.000000 -0.499199\n-0.062348 3.996456 -0.499199\n0.039198 0.039814 16.564627\nBa Bi Br O\n1 4 2 6\ndirect\n0.499999 0.500000 -0.000000 Ba\n0.085901 0.085901 0.171802 Bi\n0.914098 0.914099 0.828198 Bi\n0.787583 0.787584 0.575168 Bi\n0.212416 0.212416 0.424832 Bi\n0.335771 0.335771 0.671542 Br\n0.664228 0.664229 0.328458 Br\n0.943325 0.443325 0.886651 O\n0.056674 0.556675 0.113349 O\n0.556674 0.056674 0.113349 O\n0.443325 0.943326 0.886651 O\n0.250000 0.750000 0.500000 O\n0.750000 0.250000 0.500000 O\n",
"nsites": 13,
"nelements": 4,
"elements": [
"Ba",
"Bi",
"Br",
"O"
],
"chemical_system": "Ba-Bi-Br-O",
"density": 7.708581479845388,
"density_atomic": 0.049101878903416454,
"volume": 264.7556527433714,
"volume_molar": 12.264583137125099,
"formula_full": "Ba1 Bi4 Br2 O6",
"formula_reduced": "BaBi4(BrO3)2",
"formula_anonymous": "AB2C4D6",
"energy_above_hull": 1.5527355676923078,
"spacegroup": 139
},
{
"id": "jvasp-69423",
"created_at": "2022-09-04T14:36:20.925162Z",
"updated_at": "2022-09-04T14:36:20.925191Z",
"structure_string": "Zr1 Be2 Bi1\n1.0\n-1.912544 1.912544 4.685326\n1.912544 -1.912544 4.685326\n1.912544 1.912544 -4.685326\nZr Be Bi\n1 2 1\ndirect\n0.749999 0.250000 0.499999 Zr\n0.000000 0.000000 0.000000 Be\n0.250000 0.749999 0.499999 Be\n0.500000 0.500000 0.000000 Bi\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Zr",
"Be",
"Bi"
],
"chemical_system": "Be-Bi-Zr",
"density": 7.708428589542317,
"density_atomic": 0.058349523703865154,
"volume": 68.55240190649636,
"volume_molar": 10.320805342925336,
"formula_full": "Zr1 Be2 Bi1",
"formula_reduced": "ZrBe2Bi",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.25805775,
"spacegroup": 119
},
{
"id": "jvasp-12292",
"created_at": "2022-09-04T14:37:52.001019Z",
"updated_at": "2022-09-04T14:37:52.001045Z",
"structure_string": "Nb4 Cr4 N4\n1.0\n4.307597 -0.000000 -0.000000\n0.000000 4.307597 0.000000\n0.000000 0.000000 7.379833\nNb Cr N\n4 4 4\ndirect\n0.000000 0.500000 0.004212 Nb\n0.500000 0.000000 0.004212 Nb\n0.000000 0.000000 0.649122 Nb\n0.500000 0.500000 0.649122 Nb\n0.000000 0.000000 0.242226 Cr\n0.500000 0.500000 0.242226 Cr\n0.000000 0.500000 0.411106 Cr\n0.500000 0.000000 0.411106 Cr\n0.000000 0.000000 0.966512 N\n0.500000 0.500000 0.966512 N\n0.000000 0.500000 0.686820 N\n0.500000 0.000000 0.686820 N\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Nb",
"Cr",
"N"
],
"chemical_system": "Cr-N-Nb",
"density": 7.7079947393344845,
"density_atomic": 0.0876323746311945,
"volume": 136.93569357788874,
"volume_molar": 6.87205018161895,
"formula_full": "Nb4 Cr4 N4",
"formula_reduced": "NbCrN",
"formula_anonymous": "ABC",
"energy_above_hull": 4.299026683333333,
"spacegroup": 129
},
{
"id": "jvasp-99557",
"created_at": "2022-09-04T14:38:39.520201Z",
"updated_at": "2022-09-04T14:38:39.520222Z",
"structure_string": "Ce1 Al1 Ni4\n1.0\n5.081540 -0.000000 0.000000\n-2.540770 4.400743 0.000000\n-0.000000 -0.000000 3.871481\nCe Al Ni\n1 1 4\ndirect\n0.666667 0.333333 -0.000000 Ce\n0.000000 0.000000 0.000000 Al\n0.333333 0.666666 -0.000000 Ni\n0.662748 0.831374 0.500000 Ni\n0.168625 0.831374 0.500000 Ni\n0.168625 0.337252 0.500000 Ni\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ce",
"Al",
"Ni"
],
"chemical_system": "Al-Ce-Ni",
"density": 7.707924059355843,
"density_atomic": 0.06930311616392243,
"volume": 86.57619356982765,
"volume_molar": 8.689567069041816,
"formula_full": "Ce1 Al1 Ni4",
"formula_reduced": "CeAlNi4",
"formula_anonymous": "ABC4",
"energy_above_hull": 1.4056679833333336,
"spacegroup": 187
},
{
"id": "jvasp-16519",
"created_at": "2022-09-04T14:37:42.152846Z",
"updated_at": "2022-09-04T14:37:42.152878Z",
"structure_string": "Ga3 Ni2\n1.0\n2.034439 -3.523752 0.000000\n2.034439 3.523752 -0.000000\n0.000000 -0.000000 4.906810\nGa Ni\n3 2\ndirect\n0.666667 0.333333 0.639252 Ga\n0.333333 0.666667 0.360748 Ga\n0.000000 0.000000 0.000000 Ga\n0.666667 0.333333 0.142368 Ni\n0.333333 0.666667 0.857632 Ni\n",
"nsites": 5,
"nelements": 2,
"elements": [
"Ga",
"Ni"
],
"chemical_system": "Ga-Ni",
"density": 7.707743502786273,
"density_atomic": 0.07107072716484465,
"volume": 70.35245310495803,
"volume_molar": 8.473447508187126,
"formula_full": "Ga3 Ni2",
"formula_reduced": "Ga3Ni2",
"formula_anonymous": "A2B3",
"energy_above_hull": 0.1075517714285715,
"spacegroup": 164
},
{
"id": "jvasp-37078",
"created_at": "2022-09-04T14:38:10.410194Z",
"updated_at": "2022-09-04T14:38:10.410210Z",
"structure_string": "Ta1 In1 Se2\n1.0\n1.725228 -2.988183 -0.000000\n1.725228 2.988183 -0.000000\n0.000000 0.000000 9.479849\nTa In Se\n1 1 2\ndirect\n0.333334 0.666667 0.500000 Ta\n0.000000 0.000000 0.000000 In\n0.000000 0.000000 0.676922 Se\n0.000000 0.000000 0.323079 Se\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ta",
"In",
"Se"
],
"chemical_system": "In-Se-Ta",
"density": 7.7076015671857965,
"density_atomic": 0.040923699521466204,
"volume": 97.74287385483885,
"volume_molar": 14.715533616019083,
"formula_full": "Ta1 In1 Se2",
"formula_reduced": "TaInSe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.082583975833333,
"spacegroup": 187
},
{
"id": "jvasp-78833",
"created_at": "2022-09-04T14:37:12.937005Z",
"updated_at": "2022-09-04T14:37:12.937029Z",
"structure_string": "Tl1 Cr1 Se2\n1.0\n-1.661128 -2.877157 0.000000\n-3.322255 0.000000 -0.000000\n-1.661128 -0.959052 -9.338133\nTl Cr Se\n1 1 2\ndirect\n0.161830 0.161831 0.514509 Tl\n0.996349 0.996349 0.010954 Cr\n0.384357 0.384358 0.846929 Se\n0.275464 0.275464 0.173608 Se\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Tl",
"Cr",
"Se"
],
"chemical_system": "Cr-Se-Tl",
"density": 7.707380891325747,
"density_atomic": 0.044812937343899524,
"volume": 89.25993780107628,
"volume_molar": 13.438397741673155,
"formula_full": "Tl1 Cr1 Se2",
"formula_reduced": "TlCrSe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.6443191833333333,
"spacegroup": 160
},
{
"id": "jvasp-28518",
"created_at": "2022-09-04T14:36:31.127161Z",
"updated_at": "2022-09-04T14:36:31.127188Z",
"structure_string": "Mo1 W2 Se4 S2\n1.0\n3.281526 -0.001413 -0.001404\n-1.639583 2.839292 -0.133625\n0.013597 -0.988116 19.559144\nMo W Se S\n1 2 4 2\ndirect\n0.220483 0.441493 0.009687 Mo\n0.445385 0.890090 0.680512 W\n0.667442 0.335029 0.350725 W\n0.363295 0.727049 0.437912 Se\n0.524825 0.049861 0.923076 Se\n0.582840 0.166531 0.096403 Se\n0.304908 0.609649 0.263510 Se\n0.752167 0.503352 0.601195 S\n0.805266 0.610139 0.759821 S\n",
"nsites": 9,
"nelements": 4,
"elements": [
"Mo",
"W",
"Se",
"S"
],
"chemical_system": "Mo-S-Se-W",
"density": 7.7071200986811,
"density_atomic": 0.049516976130667655,
"volume": 181.75584826202612,
"volume_molar": 12.161770024301363,
"formula_full": "Mo1 W2 Se4 S2",
"formula_reduced": "MoW2(Se2S)2",
"formula_anonymous": "AB2C2D4",
"energy_above_hull": 4.0279421518518514,
"spacegroup": 160
},
{
"id": "jvasp-106576",
"created_at": "2022-09-04T14:36:58.956619Z",
"updated_at": "2022-09-04T14:36:58.956652Z",
"structure_string": "Pm3 Er1\n1.0\n4.608302 -0.029891 -4.138323\n-0.936347 4.512272 -4.138323\n0.024487 0.029891 6.193671\nPm Er\n3 1\ndirect\n0.750000 0.250000 0.500000 Pm\n0.250000 0.750000 0.500000 Pm\n0.499999 0.500000 0.000000 Pm\n0.000000 0.000000 0.000000 Er\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Pm",
"Er"
],
"chemical_system": "Er-Pm",
"density": 7.706905384105971,
"density_atomic": 0.03082532203794516,
"volume": 129.76344562032816,
"volume_molar": 19.536343375705542,
"formula_full": "Pm3 Er1",
"formula_reduced": "Pm3Er",
"formula_anonymous": "AB3",
"energy_above_hull": 1.5303458812500002,
"spacegroup": 139
},
{
"id": "jvasp-110059",
"created_at": "2022-09-04T14:37:52.695383Z",
"updated_at": "2022-09-04T14:37:52.695403Z",
"structure_string": "Zn3 Cr1\n1.0\n3.767723 -0.000000 0.000000\n0.000000 3.767723 0.000000\n-0.000000 -0.000000 3.767723\nZn Cr\n3 1\ndirect\n-0.000000 0.500000 0.500000 Zn\n0.500000 0.000000 0.500000 Zn\n0.500000 0.500000 -0.000000 Zn\n0.000000 0.000000 0.000000 Cr\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Zn",
"Cr"
],
"chemical_system": "Cr-Zn",
"density": 7.706450508040702,
"density_atomic": 0.07478647996166785,
"volume": 53.48560330757937,
"volume_molar": 8.052445793794114,
"formula_full": "Zn3 Cr1",
"formula_reduced": "Zn3Cr",
"formula_anonymous": "AB3",
"energy_above_hull": 0.03867215,
"spacegroup": 221
},
{
"id": "jvasp-16093",
"created_at": "2022-09-04T14:35:54.809704Z",
"updated_at": "2022-09-04T14:35:54.809734Z",
"structure_string": "Sm2 Si2 Ru2\n1.0\n4.231988 0.000000 0.000000\n0.000000 4.231988 -0.000000\n0.000000 -0.000000 6.725901\nSm Si Ru\n2 2 2\ndirect\n0.000000 0.500000 0.677992 Sm\n0.500000 0.000000 0.322008 Sm\n0.000000 0.500000 0.183624 Si\n0.500000 0.000000 0.816376 Si\n0.500000 0.500000 0.000000 Ru\n0.000000 0.000000 0.000000 Ru\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Sm",
"Si",
"Ru"
],
"chemical_system": "Ru-Si-Sm",
"density": 7.7062955917834035,
"density_atomic": 0.04980947046721013,
"volume": 120.45902001607978,
"volume_molar": 12.090352905808166,
"formula_full": "Sm2 Si2 Ru2",
"formula_reduced": "SmSiRu",
"formula_anonymous": "ABC",
"energy_above_hull": 2.4621293250000003,
"spacegroup": 129
},
{
"id": "jvasp-116053",
"created_at": "2022-09-04T14:38:47.765761Z",
"updated_at": "2022-09-04T14:38:47.765786Z",
"structure_string": "Ta1 N1 F2\n1.0\n2.962087 0.000000 0.000000\n0.000000 2.962087 0.000000\n0.000000 0.000000 5.721174\nTa N F\n1 1 2\ndirect\n0.500000 0.500000 0.749720 Ta\n0.000000 0.000000 0.782012 N\n0.000000 0.000000 0.404231 F\n0.500000 0.500000 0.074036 F\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ta",
"N",
"F"
],
"chemical_system": "F-N-Ta",
"density": 7.706081900521727,
"density_atomic": 0.0796854839908649,
"volume": 50.197348370985075,
"volume_molar": 7.557387441720721,
"formula_full": "Ta1 N1 F2",
"formula_reduced": "TaNF2",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.49600075375,
"spacegroup": 99
}
]
}