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=chemical_system&page=3825",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=chemical_system&page=3823",
"results": [
{
"id": "jvasp-9130",
"created_at": "2022-09-04T14:38:34.773903Z",
"updated_at": "2022-09-04T14:38:34.773930Z",
"structure_string": "Mg4 O8\n1.0\n4.869115 -0.000000 0.000000\n-0.000000 4.869115 0.000000\n-0.000000 0.000000 4.869115\nMg O\n4 8\ndirect\n0.000000 0.500000 0.500000 Mg\n0.500000 0.500000 0.000000 Mg\n0.500000 0.000000 0.500000 Mg\n0.000000 0.000000 0.000000 Mg\n0.410472 0.089528 0.910473 O\n0.089528 0.910473 0.410472 O\n0.910473 0.410472 0.089528 O\n0.589529 0.589529 0.589529 O\n0.410472 0.410472 0.410472 O\n0.089528 0.589529 0.910473 O\n0.910473 0.089528 0.589529 O\n0.589529 0.910473 0.089528 O\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Mg",
"O"
],
"chemical_system": "Mg-O",
"density": 3.2396396060329247,
"density_atomic": 0.10395159328114609,
"volume": 115.43834607272407,
"volume_molar": 5.7932164095961465,
"formula_full": "Mg4 O8",
"formula_reduced": "MgO2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.1884911666666669,
"spacegroup": 205
},
{
"id": "jvasp-36311",
"created_at": "2022-09-04T14:37:14.367535Z",
"updated_at": "2022-09-04T14:37:14.367561Z",
"structure_string": "Mg1 O1\n1.0\n2.640580 -0.000000 0.000000\n-0.000000 2.640580 -0.000000\n0.000000 0.000000 2.640580\nMg O\n1 1\ndirect\n0.000000 0.000000 0.000000 Mg\n0.500000 0.500000 0.500000 O\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Mg",
"O"
],
"chemical_system": "Mg-O",
"density": 3.6349929180177583,
"density_atomic": 0.10862555463657045,
"volume": 18.411873768483108,
"volume_molar": 5.543944774457847,
"formula_full": "Mg1 O1",
"formula_reduced": "MgO",
"formula_anonymous": "AB",
"energy_above_hull": 0.4029799999999999,
"spacegroup": 221
},
{
"id": "jvasp-78570",
"created_at": "2022-09-04T14:37:10.727539Z",
"updated_at": "2022-09-04T14:37:10.727549Z",
"structure_string": "Mg1 O2\n1.0\n-1.856346 -2.839283 0.244196\n-1.530717 2.651281 -0.000000\n0.281235 0.162371 -3.773162\nMg O\n1 2\ndirect\n0.000000 0.000000 0.000000 Mg\n0.650992 0.325498 0.218600 O\n0.349011 0.674506 0.781398 O\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Mg",
"O"
],
"chemical_system": "Mg-O",
"density": 2.6923328258765276,
"density_atomic": 0.086389944848128,
"volume": 34.72626363257839,
"volume_molar": 6.970881588808531,
"formula_full": "Mg1 O2",
"formula_reduced": "MgO2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.4201211666666669,
"spacegroup": 12
},
{
"id": "jvasp-36313",
"created_at": "2022-09-04T14:37:15.129435Z",
"updated_at": "2022-09-04T14:37:15.129461Z",
"structure_string": "Mg1 O1\n1.0\n1.457720 -2.524846 -0.000000\n1.457720 2.524846 0.000000\n-0.000000 0.000000 2.662101\nMg O\n1 1\ndirect\n0.000000 0.000000 0.000000 Mg\n0.333333 0.666667 0.500000 O\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Mg",
"O"
],
"chemical_system": "Mg-O",
"density": 3.415372106556683,
"density_atomic": 0.10206256180749433,
"volume": 19.595824017942125,
"volume_molar": 5.900440527211813,
"formula_full": "Mg1 O1",
"formula_reduced": "MgO",
"formula_anonymous": "AB",
"energy_above_hull": 0.1919949999999999,
"spacegroup": 187
},
{
"id": "jvasp-79569",
"created_at": "2022-09-04T14:37:13.358563Z",
"updated_at": "2022-09-04T14:37:13.358581Z",
"structure_string": "Mg2 O2\n1.0\n-1.752268 -3.034747 0.000000\n-1.752268 3.034747 -0.000000\n0.000000 0.000000 -4.221306\nMg O\n2 2\ndirect\n0.666675 0.333327 0.750001 Mg\n0.333327 0.666675 0.250000 Mg\n0.666675 0.333326 0.250000 O\n0.333326 0.666675 0.750001 O\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Mg",
"O"
],
"chemical_system": "Mg-O",
"density": 2.9814786381672342,
"density_atomic": 0.08909639661268257,
"volume": 44.895193880721024,
"volume_molar": 6.759129424929816,
"formula_full": "Mg2 O2",
"formula_reduced": "MgO",
"formula_anonymous": "AB",
"energy_above_hull": 0.0426449999999998,
"spacegroup": 194
},
{
"id": "jvasp-107154",
"created_at": "2022-09-04T14:36:58.680896Z",
"updated_at": "2022-09-04T14:36:58.680916Z",
"structure_string": "Mg1 O2\n1.0\n2.913015 0.006839 2.648285\n1.175706 2.665223 2.648285\n0.010465 0.006839 3.936871\nMg O\n1 2\ndirect\n0.000000 0.000000 0.000000 Mg\n0.571844 0.571844 0.571844 O\n0.428155 0.428155 0.428155 O\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Mg",
"O"
],
"chemical_system": "Mg-O",
"density": 3.0726097910018453,
"density_atomic": 0.09859204175399408,
"volume": 30.42841944064381,
"volume_molar": 6.108140832529251,
"formula_full": "Mg1 O2",
"formula_reduced": "MgO2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.2099845,
"spacegroup": 166
},
{
"id": "jvasp-116",
"created_at": "2022-09-04T14:37:03.925401Z",
"updated_at": "2022-09-04T14:37:03.925427Z",
"structure_string": "Mg1 O1\n1.0\n2.588985 0.000000 1.494751\n0.862995 2.440918 1.494751\n0.000000 0.000000 2.989502\nMg O\n1 1\ndirect\n0.000000 0.000000 0.000000 Mg\n0.499998 0.500000 0.500000 O\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Mg",
"O"
],
"chemical_system": "Mg-O",
"density": 3.542582600394026,
"density_atomic": 0.10586403013503343,
"volume": 18.89215815276376,
"volume_molar": 5.6885617828062465,
"formula_full": "Mg1 O1",
"formula_reduced": "MgO",
"formula_anonymous": "AB",
"energy_above_hull": 0.01485,
"spacegroup": 225
},
{
"id": "jvasp-115236",
"created_at": "2022-09-04T14:38:44.485111Z",
"updated_at": "2022-09-04T14:38:44.485128Z",
"structure_string": "Mg1 O2\n1.0\n3.657324 -0.403643 -0.607463\n-0.905549 -2.864761 -0.034313\n-1.393719 4.853321 -2.078775\nMg O\n1 2\ndirect\n0.078824 0.195691 0.120916 Mg\n0.602495 0.356980 -0.061741 O\n0.555164 0.034457 0.303635 O\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Mg",
"O"
],
"chemical_system": "Mg-O",
"density": 3.312498819345955,
"density_atomic": 0.10628945558379117,
"volume": 28.224812927327584,
"volume_molar": 5.66579321243448,
"formula_full": "Mg1 O2",
"formula_reduced": "MgO2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.2580045,
"spacegroup": 12
},
{
"id": "jvasp-115239",
"created_at": "2022-09-04T14:38:45.824062Z",
"updated_at": "2022-09-04T14:38:45.824104Z",
"structure_string": "Mg3 O1\n1.0\n4.247901 0.137842 1.300610\n4.028310 -3.046686 2.070410\n-0.412542 0.206328 -5.527445\nMg O\n3 1\ndirect\n-0.058753 0.153503 0.142152 Mg\n-0.029929 0.474601 0.810166 Mg\n0.947733 0.814661 0.465403 Mg\n0.711435 0.980429 0.806990 O\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Mg",
"O"
],
"chemical_system": "Mg-O",
"density": 2.0472401173856216,
"density_atomic": 0.05546353868743734,
"volume": 72.1194517093806,
"volume_molar": 10.857837243197814,
"formula_full": "Mg3 O1",
"formula_reduced": "Mg3O",
"formula_anonymous": "AB3",
"energy_above_hull": 0.1568770249999999,
"spacegroup": 1
},
{
"id": "jvasp-115234",
"created_at": "2022-09-04T14:38:45.492960Z",
"updated_at": "2022-09-04T14:38:45.492986Z",
"structure_string": "Mg1 O2\n1.0\n3.134255 0.000000 0.000000\n0.000000 3.722753 0.000000\n0.000000 0.000000 3.791445\nMg O\n1 2\ndirect\n0.466669 0.000000 0.000000 Mg\n-0.033334 0.000000 0.690581 O\n-0.033334 0.000000 0.309417 O\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Mg",
"O"
],
"chemical_system": "Mg-O",
"density": 2.113408716555653,
"density_atomic": 0.06781377870893625,
"volume": 44.23879714587665,
"volume_molar": 8.880408782185182,
"formula_full": "Mg1 O2",
"formula_reduced": "MgO2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.3743645,
"spacegroup": 47
},
{
"id": "jvasp-115228",
"created_at": "2022-09-04T14:38:45.753359Z",
"updated_at": "2022-09-04T14:38:45.753385Z",
"structure_string": "Mg1 O1\n1.0\n5.291772 0.000000 0.000000\n0.000000 5.291772 0.000000\n0.000000 0.000000 7.408481\nMg O\n1 1\ndirect\n0.000000 0.000000 0.862108 Mg\n0.000000 0.000000 0.137892 O\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Mg",
"O"
],
"chemical_system": "Mg-O",
"density": 0.322604289996484,
"density_atomic": 0.009640478185062007,
"volume": 207.45858883836436,
"volume_molar": 62.46724119277975,
"formula_full": "Mg1 O1",
"formula_reduced": "MgO",
"formula_anonymous": "AB",
"energy_above_hull": 1.947705,
"spacegroup": 99
},
{
"id": "jvasp-115233",
"created_at": "2022-09-04T14:38:43.758112Z",
"updated_at": "2022-09-04T14:38:43.758142Z",
"structure_string": "Mg2 O1\n1.0\n3.102638 0.000000 0.820356\n0.000000 3.656830 0.000000\n1.676974 0.000000 6.163804\nMg O\n2 1\ndirect\n0.036283 0.000000 -0.103325 Mg\n0.010658 0.000000 0.422725 Mg\n0.353059 0.000000 0.080600 O\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Mg",
"O"
],
"chemical_system": "Mg-O",
"density": 1.653036229089683,
"density_atomic": 0.04622307368462414,
"volume": 64.90265057812316,
"volume_molar": 13.02842991595177,
"formula_full": "Mg2 O1",
"formula_reduced": "Mg2O",
"formula_anonymous": "AB2",
"energy_above_hull": 0.3860630166666667,
"spacegroup": 25
}
]
}