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=structure_string&page=91",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=structure_string&page=89",
"results": [
{
"id": "jvasp-50935",
"created_at": "2022-09-04T14:35:43.651587Z",
"updated_at": "2022-09-04T14:35:43.651612Z",
"structure_string": "Al2 In2 O6\n1.0\n3.275877 0.000023 -0.000006\n1.637958 2.837094 0.000031\n-0.000022 0.000140 12.022365\nAl In O\n2 2 6\ndirect\n0.333390 0.333275 0.250000 Al\n0.666714 0.666623 0.750000 Al\n-0.000000 -0.000000 -0.000001 In\n-0.000010 0.000010 0.500004 In\n0.000058 -0.000058 0.249999 O\n0.000037 -0.000035 0.749998 O\n0.333318 0.333340 0.407927 O\n0.333330 0.333329 0.092074 O\n0.666682 0.666660 0.592077 O\n0.666691 0.666649 0.907923 O\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Al",
"In",
"O"
],
"chemical_system": "Al-In-O",
"density": 5.641319097501746,
"density_atomic": 0.08949742483647263,
"volume": 111.73505850332275,
"volume_molar": 6.728842501338446,
"formula_full": "Al2 In2 O6",
"formula_reduced": "AlInO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.2972426540000002,
"spacegroup": 194
},
{
"id": "jvasp-111849",
"created_at": "2022-09-04T14:38:42.340413Z",
"updated_at": "2022-09-04T14:38:42.340440Z",
"structure_string": "Al2 In4 N6\n1.0\n5.927412 -0.000449 -0.000000\n-2.950058 5.125835 0.000000\n0.000000 -0.000000 5.499476\nAl In N\n2 4 6\ndirect\n-0.000001 0.658745 0.489382 Al\n-0.000000 0.341254 0.989383 Al\n0.323843 0.335328 0.487493 In\n0.676156 0.011484 0.487493 In\n0.676155 0.664671 0.987493 In\n0.323843 0.988515 0.987493 In\n0.302002 0.332976 0.885230 N\n0.697997 0.030974 0.885230 N\n0.697997 0.667023 0.385230 N\n0.302001 0.969025 0.385230 N\n-0.000001 0.631595 0.837176 N\n-0.000000 0.368404 0.337175 N\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Al",
"In",
"N"
],
"chemical_system": "Al-In-N",
"density": 5.935967597333171,
"density_atomic": 0.07182061698158533,
"volume": 167.08294225705103,
"volume_molar": 8.384974973890944,
"formula_full": "Al2 In4 N6",
"formula_reduced": "AlIn2N3",
"formula_anonymous": "AB2C3",
"energy_above_hull": 2.900788748333333,
"spacegroup": 36
},
{
"id": "jvasp-40110",
"created_at": "2022-09-04T14:37:54.842331Z",
"updated_at": "2022-09-04T14:37:54.842344Z",
"structure_string": "Al2 Ir1 Os1\n1.0\n-0.000000 3.021234 3.021234\n3.021234 0.000000 3.021234\n3.021234 3.021234 0.000000\nAl Ir Os\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Al\n0.499999 0.499999 0.499999 Al\n0.250000 0.250000 0.250000 Ir\n0.750000 0.750000 0.750000 Os\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Al",
"Ir",
"Os"
],
"chemical_system": "Al-Ir-Os",
"density": 13.138953686404108,
"density_atomic": 0.07252319109920884,
"volume": 55.15477103769689,
"volume_molar": 8.303744869364547,
"formula_full": "Al2 Ir1 Os1",
"formula_reduced": "Al2IrOs",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.303677925,
"spacegroup": 225
},
{
"id": "jvasp-41971",
"created_at": "2022-09-04T14:37:32.573282Z",
"updated_at": "2022-09-04T14:37:32.573307Z",
"structure_string": "Al2 Ir1 Rh1\n1.0\n0.000001 3.013779 3.013780\n3.013786 -0.000000 3.013781\n3.013789 3.013783 -0.000003\nAl Ir Rh\n2 1 1\ndirect\n0.500001 0.500002 0.500001 Al\n0.000001 -0.000000 0.000000 Al\n0.250000 0.250000 0.250000 Ir\n0.749998 0.750001 0.750001 Rh\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Al",
"Ir",
"Rh"
],
"chemical_system": "Al-Ir-Rh",
"density": 10.588024247154173,
"density_atomic": 0.07306239681413047,
"volume": 54.74772488200646,
"volume_molar": 8.242462638229933,
"formula_full": "Al2 Ir1 Rh1",
"formula_reduced": "Al2IrRh",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.463807425,
"spacegroup": 225
},
{
"id": "jvasp-39905",
"created_at": "2022-09-04T14:37:48.694808Z",
"updated_at": "2022-09-04T14:37:48.694831Z",
"structure_string": "Al2 Ir1 Ru1\n1.0\n0.000000 3.009824 3.009824\n3.009824 0.000000 3.009824\n3.009824 3.009824 0.000000\nAl Ir Ru\n2 1 1\ndirect\n0.499998 0.499998 0.499998 Al\n0.000000 0.000000 0.000000 Al\n0.250000 0.250000 0.250000 Ir\n0.749999 0.749999 0.749999 Ru\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Al",
"Ir",
"Ru"
],
"chemical_system": "Al-Ir-Ru",
"density": 10.573971854967281,
"density_atomic": 0.07335111046005205,
"volume": 54.532235093815665,
"volume_molar": 8.210019892309242,
"formula_full": "Al2 Ir1 Ru1",
"formula_reduced": "Al2IrRu",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.9009868,
"spacegroup": 225
},
{
"id": "jvasp-14884",
"created_at": "2022-09-04T14:35:44.048959Z",
"updated_at": "2022-09-04T14:35:44.048980Z",
"structure_string": "Al2 Mo6\n1.0\n4.972868 -0.000000 0.000000\n0.000000 4.972868 0.000000\n-0.000000 0.000000 4.972868\nAl Mo\n2 6\ndirect\n0.000000 0.000000 0.000000 Al\n0.500000 0.500000 0.500000 Al\n0.250000 0.000000 0.500000 Mo\n0.750000 0.000000 0.500000 Mo\n0.000000 0.500000 0.250000 Mo\n0.000000 0.500000 0.750000 Mo\n0.500000 0.750000 0.000000 Mo\n0.500000 0.250000 0.000000 Mo\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Al",
"Mo"
],
"chemical_system": "Al-Mo",
"density": 8.501491894268995,
"density_atomic": 0.06505327909471606,
"volume": 122.97612220826235,
"volume_molar": 9.257243975713973,
"formula_full": "Al2 Mo6",
"formula_reduced": "AlMo3",
"formula_anonymous": "AB3",
"energy_above_hull": 4.848807625,
"spacegroup": 223
},
{
"id": "jvasp-30708",
"created_at": "2022-09-04T14:38:15.092600Z",
"updated_at": "2022-09-04T14:38:15.092610Z",
"structure_string": "Al2 Mo6 F30\n1.0\n9.888766 0.192386 0.000000\n-1.537760 5.482995 0.000000\n0.000000 0.000000 9.790576\nAl Mo F\n2 6 30\ndirect\n0.906543 0.446458 0.250000 Al\n0.426791 0.553544 0.750000 Al\n0.166667 0.000000 0.500000 Mo\n0.505200 0.021431 0.454391 Mo\n0.828133 0.978571 0.545609 Mo\n0.166667 0.000000 0.000000 Mo\n0.505200 0.021431 0.045609 Mo\n0.828133 0.978571 0.954391 Mo\n0.500756 0.327198 0.109105 F\n0.882284 0.248040 0.109373 F\n0.200106 0.280649 0.397805 F\n0.500756 0.327198 0.390895 F\n0.882284 0.248040 0.390627 F\n0.133228 0.719352 0.602196 F\n0.363941 0.118244 0.912567 F\n0.832578 0.672804 0.609105 F\n0.026624 0.126532 0.883895 F\n0.200106 0.280649 0.102195 F\n0.686587 0.189914 0.944080 F\n0.306710 0.873469 0.116105 F\n0.451050 0.751961 0.609373 F\n0.832578 0.672804 0.890896 F\n0.646747 0.810088 0.444080 F\n0.133228 0.719352 0.897805 F\n0.969393 0.881758 0.412567 F\n0.646747 0.810088 0.055920 F\n0.306710 0.873469 0.383895 F\n0.686587 0.189914 0.555920 F\n0.363941 0.118244 0.587434 F\n0.026624 0.126532 0.616105 F\n0.770166 0.000724 0.750000 F\n0.561666 0.427935 0.750000 F\n0.259234 0.400931 0.750000 F\n0.771669 0.572067 0.250000 F\n0.563168 0.999278 0.250000 F\n0.074099 0.599070 0.250000 F\n0.451050 0.751961 0.890627 F\n0.969393 0.881758 0.087434 F\n",
"nsites": 38,
"nelements": 3,
"elements": [
"Al",
"Mo",
"F"
],
"chemical_system": "Al-F-Mo",
"density": 3.731968006386664,
"density_atomic": 0.07119544077121594,
"volume": 533.7420428663638,
"volume_molar": 8.458604504397886,
"formula_full": "Al2 Mo6 F30",
"formula_reduced": "AlMo3F15",
"formula_anonymous": "AB3C15",
"energy_above_hull": 1.021308144078947,
"spacegroup": 11
},
{
"id": "jvasp-39",
"created_at": "2022-09-04T14:37:37.789608Z",
"updated_at": "2022-09-04T14:37:37.789641Z",
"structure_string": "Al2 N2\n1.0\n1.565022 -2.710698 0.000000\n1.565022 2.710698 0.000000\n0.000000 0.000000 5.021253\nAl N\n2 2\ndirect\n0.666666 0.333332 0.499331 Al\n0.333332 0.666666 0.999331 Al\n0.666666 0.333332 0.880668 N\n0.333332 0.666666 0.380668 N\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Al",
"N"
],
"chemical_system": "Al-N",
"density": 3.1951751260030994,
"density_atomic": 0.09388934497073487,
"volume": 42.60334334259966,
"volume_molar": 6.414083261393602,
"formula_full": "Al2 N2",
"formula_reduced": "AlN",
"formula_anonymous": "AB",
"energy_above_hull": 1.4526080249999995,
"spacegroup": 186
},
{
"id": "jvasp-4849",
"created_at": "2022-09-04T14:35:56.013323Z",
"updated_at": "2022-09-04T14:35:56.013340Z",
"structure_string": "Al2 N2\n1.0\n1.656458 -2.869069 0.000000\n1.656458 2.869069 0.000000\n0.000000 0.000000 4.187749\nAl N\n2 2\ndirect\n0.666668 0.333334 0.250000 Al\n0.333334 0.666668 0.750000 Al\n0.666668 0.333334 0.750000 N\n0.333334 0.666668 0.250000 N\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Al",
"N"
],
"chemical_system": "Al-N",
"density": 3.4198439383083596,
"density_atomic": 0.10049117641685054,
"volume": 39.80448973358096,
"volume_molar": 5.992706001389986,
"formula_full": "Al2 N2",
"formula_reduced": "AlN",
"formula_anonymous": "AB",
"energy_above_hull": 1.5160380249999998,
"spacegroup": 194
},
{
"id": "jvasp-121173",
"created_at": "2022-09-04T14:38:54.862830Z",
"updated_at": "2022-09-04T14:38:54.862854Z",
"structure_string": "Al2 N2 O2\n1.0\n-1.869088 1.869088 4.524693\n1.869088 -1.869088 4.524693\n1.869088 1.869088 -4.524693\nAl N O\n2 2 2\ndirect\n0.016158 0.016158 0.000000 Al\n0.766159 0.266157 0.500001 Al\n0.511310 0.011309 0.500001 N\n0.761309 0.761309 0.000000 N\n0.222611 0.222611 0.000000 O\n0.972612 0.472611 0.500001 O\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Al",
"N",
"O"
],
"chemical_system": "Al-N-O",
"density": 2.9933062130482475,
"density_atomic": 0.09489484984023464,
"volume": 63.227878120905665,
"volume_molar": 6.346119700003636,
"formula_full": "Al2 N2 O2",
"formula_reduced": "AlNO",
"formula_anonymous": "ABC",
"energy_above_hull": null,
"spacegroup": 109
},
{
"id": "jvasp-121177",
"created_at": "2022-09-04T14:38:55.315138Z",
"updated_at": "2022-09-04T14:38:55.315164Z",
"structure_string": "Al2 N3 O1\n1.0\n4.922235 0.000000 0.000000\n-2.461117 4.262780 -0.000000\n0.000000 -0.000000 2.753743\nAl N O\n2 3 1\ndirect\n0.666666 0.333333 0.499999 Al\n0.333333 0.666666 0.499999 Al\n0.500000 0.500000 0.000000 N\n0.500000 -0.000000 0.000000 N\n0.000000 0.500000 0.000000 N\n0.000000 0.000000 0.000000 O\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Al",
"N",
"O"
],
"chemical_system": "Al-N-O",
"density": 3.2182582100789845,
"density_atomic": 0.10384188916390945,
"volume": 57.78015065316548,
"volume_molar": 5.799336672789475,
"formula_full": "Al2 N3 O1",
"formula_reduced": "Al2N3O",
"formula_anonymous": "AB2C3",
"energy_above_hull": null,
"spacegroup": 191
},
{
"id": "jvasp-99747",
"created_at": "2022-09-04T14:36:36.798722Z",
"updated_at": "2022-09-04T14:36:36.798747Z",
"structure_string": "Al2 Ni1 Os1\n1.0\n3.636579 -0.000000 2.099579\n1.212193 3.428599 2.099579\n-0.000000 -0.000000 4.199160\nAl Ni Os\n2 1 1\ndirect\n0.750000 0.750000 0.750000 Al\n0.250000 0.250000 0.250000 Al\n0.500000 0.500000 0.500000 Ni\n0.000000 0.000000 0.000000 Os\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Al",
"Ni",
"Os"
],
"chemical_system": "Al-Ni-Os",
"density": 9.606315323558924,
"density_atomic": 0.0763990305783235,
"volume": 52.356685284105026,
"volume_molar": 7.882483212697527,
"formula_full": "Al2 Ni1 Os1",
"formula_reduced": "Al2NiOs",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.45209075,
"spacegroup": 225
}
]
}