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=3665",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=chemical_system&page=3663",
"results": [
{
"id": "jvasp-93294",
"created_at": "2022-09-04T14:36:05.781668Z",
"updated_at": "2022-09-04T14:36:05.781694Z",
"structure_string": "Li5 Mg1\n1.0\n-4.557744 2.631413 0.000000\n0.000007 -5.262817 0.000180\n-1.519349 2.631238 4.982988\nLi Mg\n5 1\ndirect\n-0.000266 -0.000000 0.000000 Li\n0.666933 0.333601 0.000002 Li\n0.333334 0.666399 -0.000002 Li\n0.499712 0.833617 0.500853 Li\n0.166948 0.166384 0.499148 Li\n0.833332 0.500000 0.500000 Mg\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Li",
"Mg"
],
"chemical_system": "Li-Mg",
"density": 0.8198072954785812,
"density_atomic": 0.05019821994054955,
"volume": 119.52615067039994,
"volume_molar": 11.99672173063528,
"formula_full": "Li5 Mg1",
"formula_reduced": "Li5Mg",
"formula_anonymous": "AB5",
"energy_above_hull": 0.626297619047619,
"spacegroup": 155
},
{
"id": "jvasp-90587",
"created_at": "2022-09-04T14:36:07.282468Z",
"updated_at": "2022-09-04T14:36:07.282499Z",
"structure_string": "Li6 Mg2\n1.0\n3.362428 0.000000 0.000000\n0.000000 9.698100 0.000000\n0.000000 0.000000 4.880480\nLi Mg\n6 2\ndirect\n0.500000 0.000000 0.916823 Li\n0.000000 0.241741 0.916523 Li\n0.500000 0.258259 0.416524 Li\n0.000000 0.500000 0.416823 Li\n0.500000 0.741740 0.416524 Li\n0.000000 0.758259 0.916523 Li\n0.000000 0.000000 0.416795 Mg\n0.500000 0.500000 0.916795 Mg\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Li",
"Mg"
],
"chemical_system": "Li-Mg",
"density": 0.9417225956602369,
"density_atomic": 0.05026755920845907,
"volume": 159.14836777381768,
"volume_molar": 11.980173405727225,
"formula_full": "Li6 Mg2",
"formula_reduced": "Li3Mg",
"formula_anonymous": "AB3",
"energy_above_hull": 0.5173414285714286,
"spacegroup": 71
},
{
"id": "jvasp-90586",
"created_at": "2022-09-04T14:36:01.854629Z",
"updated_at": "2022-09-04T14:36:01.854648Z",
"structure_string": "Li4 Mg4\n1.0\n10.801436 0.000000 0.232785\n0.000000 3.450157 0.000000\n-2.273150 0.000000 4.290397\nLi Mg\n4 4\ndirect\n0.867096 0.500000 0.616984 Li\n0.632905 0.000000 0.383018 Li\n0.367096 0.000000 0.616984 Li\n0.132904 0.500000 0.383018 Li\n0.616380 0.500000 0.866468 Mg\n0.883621 0.000000 0.133535 Mg\n0.116380 0.000000 0.866467 Mg\n0.383621 0.500000 0.133534 Mg\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Li",
"Mg"
],
"chemical_system": "Li-Mg",
"density": 1.2833787521915667,
"density_atomic": 0.04946993213058722,
"volume": 161.71439206510667,
"volume_molar": 12.173335399173743,
"formula_full": "Li4 Mg4",
"formula_reduced": "LiMg",
"formula_anonymous": "AB",
"energy_above_hull": 0.3530728571428572,
"spacegroup": 74
},
{
"id": "jvasp-119538",
"created_at": "2022-09-04T14:38:48.623059Z",
"updated_at": "2022-09-04T14:38:48.623076Z",
"structure_string": "Li2 Mg1 Mn3 O8\n1.0\n5.014795 0.004081 3.052660\n1.717556 4.711488 3.052669\n0.005875 0.004104 5.870840\nLi Mg Mn O\n2 1 3 8\ndirect\n0.116894 0.116895 0.116895 Li\n0.883106 0.883105 0.883105 Li\n0.500001 0.500000 0.499999 Mg\n0.500001 0.499999 -0.000000 Mn\n0.500000 0.000000 0.500000 Mn\n-0.000000 0.499999 0.500001 Mn\n0.262609 0.262609 0.262610 O\n0.710338 0.252745 0.252743 O\n0.252745 0.710338 0.252744 O\n0.252745 0.252744 0.710338 O\n0.747257 0.747256 0.289662 O\n0.747255 0.289663 0.747256 O\n0.289663 0.747255 0.747256 O\n0.737391 0.737390 0.737391 O\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Li",
"Mg",
"Mn",
"O"
],
"chemical_system": "Li-Mg-Mn-O",
"density": 3.9671952838084197,
"density_atomic": 0.10105070136701708,
"volume": 138.544313009287,
"volume_molar": 5.9595239602816115,
"formula_full": "Li2 Mg1 Mn3 O8",
"formula_reduced": "Li2MgMn3O8",
"formula_anonymous": "AB2C3D8",
"energy_above_hull": 2.715241341009852,
"spacegroup": 166
},
{
"id": "jvasp-96563",
"created_at": "2022-09-04T14:35:56.733253Z",
"updated_at": "2022-09-04T14:35:56.733270Z",
"structure_string": "Li8 Mg4 Mn12 O32\n1.0\n8.211596 -0.000000 0.000000\n0.000000 8.211596 0.000000\n-0.000000 -0.000000 8.211596\nLi Mg Mn O\n8 4 12 32\ndirect\n0.497337 0.997337 0.502664 Li\n0.247337 0.247337 0.247337 Li\n0.252664 0.752664 0.747337 Li\n0.747337 0.252664 0.752664 Li\n0.997337 0.502664 0.497337 Li\n0.752664 0.747337 0.252664 Li\n0.502664 0.497337 0.997337 Li\n0.002663 0.002663 0.002663 Li\n0.625000 0.625000 0.625000 Mg\n0.875000 0.375000 0.125000 Mg\n0.375000 0.125000 0.875000 Mg\n0.125000 0.875000 0.375000 Mg\n0.120188 0.129812 0.625000 Mn\n0.870189 0.125000 0.379812 Mn\n0.370188 0.375000 0.620189 Mn\n0.129812 0.625000 0.120188 Mn\n0.875000 0.879812 0.629812 Mn\n0.625000 0.120188 0.129812 Mn\n0.379812 0.870189 0.125000 Mn\n0.620189 0.370188 0.375000 Mn\n0.629812 0.875000 0.879812 Mn\n0.375000 0.620189 0.370188 Mn\n0.125000 0.379812 0.870189 Mn\n0.879812 0.629812 0.875000 Mn\n0.616175 0.883826 0.116175 O\n0.357918 0.376065 0.849372 O\n0.876066 0.650629 0.642083 O\n0.623935 0.349372 0.142083 O\n0.633825 0.133825 0.366175 O\n0.849372 0.357918 0.376065 O\n0.373935 0.607918 0.599372 O\n0.116175 0.616175 0.883826 O\n0.107918 0.900629 0.626065 O\n0.349372 0.142083 0.623935 O\n0.133825 0.366175 0.633825 O\n0.642083 0.876066 0.650629 O\n0.650629 0.642083 0.876066 O\n0.883826 0.116175 0.616175 O\n0.142083 0.623935 0.349372 O\n0.626065 0.107918 0.900629 O\n0.857918 0.123935 0.150628 O\n0.900629 0.626065 0.107918 O\n0.376065 0.849372 0.357918 O\n0.383825 0.383825 0.383825 O\n0.599372 0.373935 0.607918 O\n0.400629 0.873935 0.892083 O\n0.873935 0.892083 0.400629 O\n0.150628 0.857918 0.123935 O\n0.366175 0.633825 0.133825 O\n0.099372 0.126065 0.392083 O\n0.866175 0.866175 0.866175 O\n0.392083 0.099372 0.126065 O\n0.607918 0.599372 0.373935 O\n0.126065 0.392083 0.099372 O\n0.892083 0.400629 0.873935 O\n0.123935 0.150628 0.857918 O\n",
"nsites": 56,
"nelements": 4,
"elements": [
"Li",
"Mg",
"Mn",
"O"
],
"chemical_system": "Li-Mg-Mn-O",
"density": 3.9705397695116953,
"density_atomic": 0.10113589067630249,
"volume": 553.7104545727955,
"volume_molar": 5.954504103073143,
"formula_full": "Li8 Mg4 Mn12 O32",
"formula_reduced": "Li2MgMn3O8",
"formula_anonymous": "AB2C3D8",
"energy_above_hull": 2.714900626724138,
"spacegroup": 212
},
{
"id": "jvasp-93188",
"created_at": "2022-09-04T14:36:14.812791Z",
"updated_at": "2022-09-04T14:36:14.812809Z",
"structure_string": "Li1 Mg6 Mo1\n1.0\n5.863152 -1.571302 0.000000\n-4.292363 7.434593 0.000000\n0.000000 0.000000 4.332612\nLi Mg Mo\n1 6 1\ndirect\n0.250105 0.375052 0.250000 Li\n0.750010 0.374979 0.250000 Mg\n0.750010 0.875030 0.250000 Mg\n0.249972 0.112689 0.750000 Mg\n0.249972 0.637286 0.750000 Mg\n0.725409 0.112704 0.750000 Mg\n0.774558 0.637280 0.750000 Mg\n0.249962 0.874981 0.250000 Mo\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Li",
"Mg",
"Mo"
],
"chemical_system": "Li-Mg-Mo",
"density": 2.587076352518703,
"density_atomic": 0.05011354691065223,
"volume": 159.63747316196262,
"volume_molar": 12.016991674400765,
"formula_full": "Li1 Mg6 Mo1",
"formula_reduced": "LiMg6Mo",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.2462337749999999,
"spacegroup": 123
},
{
"id": "jvasp-31185",
"created_at": "2022-09-04T14:38:16.676868Z",
"updated_at": "2022-09-04T14:38:16.676898Z",
"structure_string": "Li1 Mg1 N1\n1.0\n3.518176 0.000000 0.000000\n1.759088 3.046830 0.000000\n1.759088 1.015610 2.872579\nLi Mg N\n1 1 1\ndirect\n0.750002 0.750000 0.750000 Li\n0.250001 0.250000 0.250000 Mg\n0.000000 0.000000 0.000000 N\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Li",
"Mg",
"N"
],
"chemical_system": "Li-Mg-N",
"density": 2.440370845336542,
"density_atomic": 0.09742793297833426,
"volume": 30.79199063647518,
"volume_molar": 6.181123396448517,
"formula_full": "Li1 Mg1 N1",
"formula_reduced": "LiMgN",
"formula_anonymous": "ABC",
"energy_above_hull": 1.1985974333333331,
"spacegroup": 216
},
{
"id": "jvasp-22546",
"created_at": "2022-09-04T14:37:28.948175Z",
"updated_at": "2022-09-04T14:37:28.948209Z",
"structure_string": "Li1 Mg1 N1\n1.0\n3.518176 0.000000 0.000000\n1.759088 3.046830 0.000000\n1.759088 1.015610 2.872579\nLi Mg N\n1 1 1\ndirect\n0.750002 0.750000 0.750000 Li\n0.250001 0.250000 0.250000 Mg\n0.000000 0.000000 0.000000 N\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Li",
"Mg",
"N"
],
"chemical_system": "Li-Mg-N",
"density": 2.440370845336542,
"density_atomic": 0.09742793297833426,
"volume": 30.79199063647518,
"volume_molar": 6.181123396448517,
"formula_full": "Li1 Mg1 N1",
"formula_reduced": "LiMgN",
"formula_anonymous": "ABC",
"energy_above_hull": 1.1985974333333331,
"spacegroup": 216
},
{
"id": "jvasp-13084",
"created_at": "2022-09-04T14:36:58.416634Z",
"updated_at": "2022-09-04T14:36:58.416671Z",
"structure_string": "Li4 Mg4 N4\n1.0\n3.484855 0.000000 0.000000\n0.000000 4.997523 0.000000\n0.000000 0.000000 7.174758\nLi Mg N\n4 4 4\ndirect\n0.250000 0.528813 0.094951 Li\n0.750001 0.471187 0.905049 Li\n0.750001 0.028813 0.405049 Li\n0.250000 0.971187 0.594952 Li\n0.250000 0.479924 0.644356 Mg\n0.750001 0.979924 0.855644 Mg\n0.250000 0.020076 0.144356 Mg\n0.750001 0.520075 0.355644 Mg\n0.750001 0.767221 0.118979 N\n0.750001 0.732778 0.618980 N\n0.250000 0.232779 0.881021 N\n0.250000 0.267221 0.381021 N\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Li",
"Mg",
"N"
],
"chemical_system": "Li-Mg-N",
"density": 2.405508047390951,
"density_atomic": 0.09603609109980543,
"volume": 124.95302404102443,
"volume_molar": 6.270705826355942,
"formula_full": "Li4 Mg4 N4",
"formula_reduced": "LiMgN",
"formula_anonymous": "ABC",
"energy_above_hull": 1.1995007666666664,
"spacegroup": 62
},
{
"id": "jvasp-93164",
"created_at": "2022-09-04T14:35:55.641931Z",
"updated_at": "2022-09-04T14:35:55.641952Z",
"structure_string": "Na1 Li1 Mg6\n1.0\n6.518276 0.058733 0.000000\n-3.208274 5.556893 0.000000\n0.000000 0.000000 5.171181\nNa Li Mg\n1 1 6\ndirect\n0.162594 0.831295 0.250000 Na\n0.165604 0.332801 0.250000 Li\n0.662339 0.331179 0.250000 Mg\n0.662339 0.831158 0.250000 Mg\n0.337347 0.174937 0.750000 Mg\n0.337347 0.662409 0.750000 Mg\n0.842318 0.171159 0.750000 Mg\n0.830115 0.665057 0.750000 Mg\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Na",
"Li",
"Mg"
],
"chemical_system": "Li-Mg-Na",
"density": 1.5501120180089807,
"density_atomic": 0.04248953987939083,
"volume": 188.28163408472983,
"volume_molar": 14.173231287263212,
"formula_full": "Na1 Li1 Mg6",
"formula_reduced": "NaLiMg6",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.0002449999999999,
"spacegroup": 38
},
{
"id": "jvasp-93165",
"created_at": "2022-09-04T14:35:57.929377Z",
"updated_at": "2022-09-04T14:35:57.929402Z",
"structure_string": "Na1 Li1 Mg6\n1.0\n6.511028 -0.017102 0.000000\n-3.270326 5.630165 0.000000\n0.000000 0.000000 5.148777\nNa Li Mg\n1 1 6\ndirect\n0.328707 0.171293 0.750000 Na\n0.162330 0.337669 0.250000 Li\n0.166997 0.825432 0.250000 Mg\n0.674568 0.333002 0.250000 Mg\n0.667948 0.832051 0.250000 Mg\n0.329178 0.663793 0.750000 Mg\n0.836207 0.170822 0.750000 Mg\n0.834060 0.665939 0.750000 Mg\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Na",
"Li",
"Mg"
],
"chemical_system": "Li-Mg-Na",
"density": 1.5486717646738666,
"density_atomic": 0.042450061634717026,
"volume": 188.4567346177265,
"volume_molar": 14.186412287973921,
"formula_full": "Na1 Li1 Mg6",
"formula_reduced": "NaLiMg6",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.0,
"spacegroup": 38
},
{
"id": "jvasp-93199",
"created_at": "2022-09-04T14:36:00.830951Z",
"updated_at": "2022-09-04T14:36:00.830977Z",
"structure_string": "Li1 Mg6 Nb1\n1.0\n5.908543 -1.576690 0.000000\n-4.319725 7.481983 0.000000\n0.000000 0.000000 4.460147\nLi Mg Nb\n1 6 1\ndirect\n0.249968 0.374984 0.250000 Li\n0.750002 0.375003 0.250000 Mg\n0.750003 0.874998 0.250000 Mg\n0.250007 0.116649 0.750001 Mg\n0.250007 0.633359 0.750001 Mg\n0.731748 0.115874 0.750001 Mg\n0.768263 0.634132 0.750001 Mg\n0.250002 0.874999 0.250000 Nb\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Li",
"Mg",
"Nb"
],
"chemical_system": "Li-Mg-Nb",
"density": 2.4458579088813837,
"density_atomic": 0.0479630663965338,
"volume": 166.7950070969221,
"volume_molar": 12.555787635035797,
"formula_full": "Li1 Mg6 Nb1",
"formula_reduced": "LiMg6Nb",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.1691567124999999,
"spacegroup": 123
}
]
}