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=682",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=energy_above_hull&page=680",
"results": [
{
"id": "jvasp-108879",
"created_at": "2022-09-04T14:38:49.132913Z",
"updated_at": "2022-09-04T14:38:49.132932Z",
"structure_string": "K2 Br6\n1.0\n6.428216 0.000000 0.000000\n-3.214108 5.566998 0.000000\n-0.000000 -0.000000 6.793013\nK Br\n2 6\ndirect\n0.666667 0.333333 0.250000 K\n0.333333 0.666667 0.750000 K\n0.832012 0.167989 0.750000 Br\n0.335977 0.167989 0.750000 Br\n0.832012 0.664023 0.750000 Br\n0.167989 0.832011 0.250000 Br\n0.664024 0.832011 0.250000 Br\n0.167989 0.335977 0.250000 Br\n",
"nsites": 8,
"nelements": 2,
"elements": [
"K",
"Br"
],
"chemical_system": "Br-K",
"density": 3.809025976326317,
"density_atomic": 0.03290910069801663,
"volume": 243.09385034280643,
"volume_molar": 18.299317308184435,
"formula_full": "K2 Br6",
"formula_reduced": "KBr3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.1502195525,
"spacegroup": 194
},
{
"id": "jvasp-115255",
"created_at": "2022-09-04T14:38:45.474791Z",
"updated_at": "2022-09-04T14:38:45.474818Z",
"structure_string": "Rb1 Na1 O1\n1.0\n4.098007 1.443000 0.000000\n2.178384 6.498847 0.000000\n0.000000 0.000000 4.836615\nRb Na O\n1 1 1\ndirect\n-0.077811 0.454865 0.000000 Rb\n-0.078782 -0.045098 0.000000 Na\n0.421157 -0.045107 0.000000 O\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Rb",
"Na",
"O"
],
"chemical_system": "Na-O-Rb",
"density": 1.8191306536230738,
"density_atomic": 0.02640686397261141,
"volume": 113.60682597946999,
"volume_molar": 22.805209911506438,
"formula_full": "Rb1 Na1 O1",
"formula_reduced": "RbNaO",
"formula_anonymous": "ABC",
"energy_above_hull": 0.15025,
"spacegroup": 47
},
{
"id": "jvasp-108134",
"created_at": "2022-09-04T14:38:27.059245Z",
"updated_at": "2022-09-04T14:38:27.059275Z",
"structure_string": "Cu1 Au1\n1.0\n2.734032 0.001224 3.656858\n1.216766 2.448349 3.656858\n0.001975 0.001224 4.565911\nCu Au\n1 1\ndirect\n0.500000 0.499998 0.500001 Cu\n0.000000 0.000000 0.000000 Au\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Cu",
"Au"
],
"chemical_system": "Au-Cu",
"density": 14.16830546190485,
"density_atomic": 0.06550434797006191,
"volume": 30.532324372026107,
"volume_molar": 9.193497754915992,
"formula_full": "Cu1 Au1",
"formula_reduced": "CuAu",
"formula_anonymous": "AB",
"energy_above_hull": 0.15025919,
"spacegroup": 166
},
{
"id": "jvasp-18722",
"created_at": "2022-09-04T14:37:00.173429Z",
"updated_at": "2022-09-04T14:37:00.173455Z",
"structure_string": "Ho1 In1\n1.0\n3.723606 -0.000000 -0.000000\n0.000000 3.723606 0.000000\n0.000000 0.000000 3.723606\nHo In\n1 1\ndirect\n0.000000 0.000000 0.000000 Ho\n0.500001 0.500001 0.500001 In\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Ho",
"In"
],
"chemical_system": "Ho-In",
"density": 8.997573857186914,
"density_atomic": 0.038738145977213236,
"volume": 51.628696974203436,
"volume_molar": 15.54576402170196,
"formula_full": "Ho1 In1",
"formula_reduced": "HoIn",
"formula_anonymous": "AB",
"energy_above_hull": 0.1503685222222222,
"spacegroup": 221
},
{
"id": "jvasp-14871",
"created_at": "2022-09-04T14:36:34.167128Z",
"updated_at": "2022-09-04T14:36:34.167154Z",
"structure_string": "Tm1 Te1\n1.0\n3.716519 0.000000 2.145734\n1.238839 3.503968 2.145734\n-0.000000 -0.000000 4.291466\nTm Te\n1 1\ndirect\n0.500000 0.500000 0.499999 Tm\n0.000000 0.000000 0.000000 Te\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Tm",
"Te"
],
"chemical_system": "Te-Tm",
"density": 8.810929699651917,
"density_atomic": 0.03578720910218419,
"volume": 55.88588912561875,
"volume_molar": 16.827634540611474,
"formula_full": "Tm1 Te1",
"formula_reduced": "TmTe",
"formula_anonymous": "AB",
"energy_above_hull": 0.1504310083333333,
"spacegroup": 225
},
{
"id": "jvasp-106877",
"created_at": "2022-09-04T14:38:04.700103Z",
"updated_at": "2022-09-04T14:38:04.700128Z",
"structure_string": "Na1 V1 F3\n1.0\n4.085916 -0.000000 0.000000\n0.000000 4.085916 0.000000\n-0.000000 -0.000000 4.085916\nNa V F\n1 1 3\ndirect\n0.000000 0.000000 0.000000 Na\n0.500001 0.500001 0.500001 V\n-0.000000 0.500001 0.500001 F\n0.500001 0.000000 0.500001 F\n0.500001 0.500001 -0.000000 F\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Na",
"V",
"F"
],
"chemical_system": "F-Na-V",
"density": 3.187192418760445,
"density_atomic": 0.0732996164939451,
"volume": 68.21318090269986,
"volume_molar": 8.21578754166805,
"formula_full": "Na1 V1 F3",
"formula_reduced": "NaVF3",
"formula_anonymous": "ABC3",
"energy_above_hull": 0.1506388095000002,
"spacegroup": 221
},
{
"id": "jvasp-20781",
"created_at": "2022-09-04T14:38:34.575778Z",
"updated_at": "2022-09-04T14:38:34.575803Z",
"structure_string": "Sr4 Mg8\n1.0\n3.218751 -5.575041 -0.000000\n3.218751 5.575041 0.000000\n-0.000000 0.000000 10.358802\nSr Mg\n4 8\ndirect\n0.333333 0.666667 0.939591 Sr\n0.333333 0.666667 0.560409 Sr\n0.666667 0.333333 0.060409 Sr\n0.666667 0.333333 0.439591 Sr\n0.832960 0.167040 0.750000 Mg\n0.665920 0.832960 0.250000 Mg\n0.334080 0.167040 0.750000 Mg\n0.832960 0.665920 0.750000 Mg\n0.167040 0.334080 0.250000 Mg\n0.167040 0.832960 0.250000 Mg\n0.000000 0.000000 0.500000 Mg\n0.000000 0.000000 0.000000 Mg\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Sr",
"Mg"
],
"chemical_system": "Mg-Sr",
"density": 2.4339232026030513,
"density_atomic": 0.03227797430119107,
"volume": 371.77054198091963,
"volume_molar": 18.65712111858823,
"formula_full": "Sr4 Mg8",
"formula_reduced": "SrMg2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.1507203921568627,
"spacegroup": 194
},
{
"id": "jvasp-16407",
"created_at": "2022-09-04T14:38:27.289094Z",
"updated_at": "2022-09-04T14:38:27.289119Z",
"structure_string": "Li1 Rh1 F6\n1.0\n4.400215 0.020134 3.032096\n1.603544 4.097675 3.032096\n0.029356 0.020133 5.343654\nLi Rh F\n1 1 6\ndirect\n0.500001 0.500000 0.500000 Li\n0.000000 0.000000 0.000000 Rh\n0.616972 0.239966 0.901124 F\n0.239967 0.901125 0.616970 F\n0.098876 0.383030 0.760032 F\n0.901125 0.616970 0.239968 F\n0.760034 0.098875 0.383030 F\n0.383030 0.760033 0.098876 F\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Li",
"Rh",
"F"
],
"chemical_system": "F-Li-Rh",
"density": 3.8862071415500288,
"density_atomic": 0.08364406200965688,
"volume": 95.64337034560067,
"volume_molar": 7.199722987275214,
"formula_full": "Li1 Rh1 F6",
"formula_reduced": "LiRhF6",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.1507230868749999,
"spacegroup": 148
},
{
"id": "jvasp-17986",
"created_at": "2022-09-04T14:38:14.142161Z",
"updated_at": "2022-09-04T14:38:14.142183Z",
"structure_string": "Sr1 Pb3\n1.0\n5.011463 0.000000 0.000000\n0.000000 5.011463 0.000000\n0.000000 0.000000 5.012549\nSr Pb\n1 3\ndirect\n0.000000 0.000000 0.000000 Sr\n0.000000 0.500000 0.500000 Pb\n0.500000 0.000000 0.500000 Pb\n0.500000 0.500000 0.000000 Pb\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Sr",
"Pb"
],
"chemical_system": "Pb-Sr",
"density": 9.354969675020369,
"density_atomic": 0.03177403017849072,
"volume": 125.88897214265823,
"volume_molar": 18.95302775937017,
"formula_full": "Sr1 Pb3",
"formula_reduced": "SrPb3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.15074041,
"spacegroup": 221
},
{
"id": "jvasp-110593",
"created_at": "2022-09-04T14:38:38.409205Z",
"updated_at": "2022-09-04T14:38:38.409225Z",
"structure_string": "Er2 Ga3 Cu1\n1.0\n4.332079 0.000000 -0.000000\n-2.166040 3.751691 0.000000\n-0.000000 -0.000000 7.121416\nEr Ga Cu\n2 3 1\ndirect\n0.333333 0.666667 0.731685 Er\n0.333333 0.666667 0.261608 Er\n0.666667 0.333333 0.478335 Ga\n0.666667 0.333333 0.046615 Ga\n0.000000 0.000000 0.948263 Ga\n0.000000 0.000000 0.533496 Cu\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Er",
"Ga",
"Cu"
],
"chemical_system": "Cu-Er-Ga",
"density": 8.711936021782481,
"density_atomic": 0.05183957890966316,
"volume": 115.74168089705624,
"volume_molar": 11.61687823601793,
"formula_full": "Er2 Ga3 Cu1",
"formula_reduced": "Er2Ga3Cu",
"formula_anonymous": "AB2C3",
"energy_above_hull": 0.1507553486111111,
"spacegroup": 156
},
{
"id": "jvasp-102135",
"created_at": "2022-09-04T14:36:43.109056Z",
"updated_at": "2022-09-04T14:36:43.109071Z",
"structure_string": "Yb4 Mg2\n1.0\n9.281897 0.040467 -0.000000\n-8.557245 3.595665 0.000000\n-0.000000 -0.000000 5.786737\nYb Mg\n4 2\ndirect\n0.593299 0.406703 0.750000 Yb\n0.280356 0.719646 0.750000 Yb\n0.406703 0.593299 0.250000 Yb\n0.719646 0.280356 0.250000 Yb\n0.937844 0.062158 0.750000 Mg\n0.062158 0.937844 0.250000 Mg\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Yb",
"Mg"
],
"chemical_system": "Mg-Yb",
"density": 6.303762784415519,
"density_atomic": 0.030748124372087453,
"volume": 195.13385360983784,
"volume_molar": 19.585392224661298,
"formula_full": "Yb4 Mg2",
"formula_reduced": "Yb2Mg",
"formula_anonymous": "AB2",
"energy_above_hull": 0.1508919047619047,
"spacegroup": 63
},
{
"id": "jvasp-120170",
"created_at": "2022-09-04T14:38:51.087941Z",
"updated_at": "2022-09-04T14:38:51.087961Z",
"structure_string": "Sc1 O1 F1\n1.0\n0.000000 2.534096 2.534096\n2.534096 0.000000 2.534096\n2.534096 2.534096 0.000000\nSc O F\n1 1 1\ndirect\n0.000000 0.000000 0.000000 Sc\n0.750003 0.750003 0.750003 O\n0.250001 0.250001 0.250001 F\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Sc",
"O",
"F"
],
"chemical_system": "F-O-Sc",
"density": 4.0793273817274525,
"density_atomic": 0.09217689376631201,
"volume": 32.546117333977826,
"volume_molar": 6.53324332588968,
"formula_full": "Sc1 O1 F1",
"formula_reduced": "ScOF",
"formula_anonymous": "ABC",
"energy_above_hull": 0.1510263441666666,
"spacegroup": 216
}
]
}