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=id&page=437",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=id&page=435",
"results": [
{
"id": "jvasp-107461",
"created_at": "2022-09-04T14:36:55.099526Z",
"updated_at": "2022-09-04T14:36:55.099544Z",
"structure_string": "Li1 Zn1 Cd2\n1.0\n4.050257 0.000000 2.338417\n1.350086 3.818619 2.338417\n0.000000 0.000000 4.676834\nLi Zn Cd\n1 1 2\ndirect\n0.500001 0.500000 0.500000 Li\n0.000000 0.000000 0.000000 Zn\n0.750001 0.750000 0.750000 Cd\n0.250000 0.250000 0.250000 Cd\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Li",
"Zn",
"Cd"
],
"chemical_system": "Cd-Li-Zn",
"density": 6.822069176952513,
"density_atomic": 0.055299235287662285,
"volume": 72.33373082271959,
"volume_molar": 10.890097717759199,
"formula_full": "Li1 Zn1 Cd2",
"formula_reduced": "LiZnCd2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-107462",
"created_at": "2022-09-04T14:36:54.929508Z",
"updated_at": "2022-09-04T14:36:54.929528Z",
"structure_string": "Li1 Th1 Pt2\n1.0\n4.203443 0.000000 2.426859\n1.401148 3.963044 2.426859\n0.000000 0.000000 4.853717\nLi Th Pt\n1 1 2\ndirect\n0.500000 0.500000 0.500001 Li\n0.000000 0.000000 0.000000 Th\n0.250000 0.250000 0.250000 Pt\n0.750000 0.749999 0.750001 Pt\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Li",
"Th",
"Pt"
],
"chemical_system": "Li-Pt-Th",
"density": 12.920899881891854,
"density_atomic": 0.04947109050243999,
"volume": 80.85530275106254,
"volume_molar": 12.173050358982849,
"formula_full": "Li1 Th1 Pt2",
"formula_reduced": "LiThPt2",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.0696621,
"spacegroup": 225
},
{
"id": "jvasp-107463",
"created_at": "2022-09-04T14:36:51.096020Z",
"updated_at": "2022-09-04T14:36:51.096054Z",
"structure_string": "Lu1 Sc1 Co2\n1.0\n3.879996 -0.000000 2.240117\n1.293332 3.658095 2.240117\n-0.000000 -0.000000 4.480233\nLu Sc Co\n1 1 2\ndirect\n0.500000 0.500001 0.500000 Lu\n0.000000 0.000000 0.000000 Sc\n0.750000 0.750001 0.750000 Co\n0.250000 0.250000 0.250000 Co\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Lu",
"Sc",
"Co"
],
"chemical_system": "Co-Lu-Sc",
"density": 8.820803150285697,
"density_atomic": 0.0629032570198201,
"volume": 63.58971203573205,
"volume_molar": 9.573654919176114,
"formula_full": "Lu1 Sc1 Co2",
"formula_reduced": "LuScCo2",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.5268532,
"spacegroup": 225
},
{
"id": "jvasp-107464",
"created_at": "2022-09-04T14:36:57.923091Z",
"updated_at": "2022-09-04T14:36:57.923110Z",
"structure_string": "Mg2 Ni4\n1.0\n4.146548 -0.000000 2.394011\n1.382183 3.909403 2.394011\n-0.000000 -0.000000 4.788021\nMg Ni\n2 4\ndirect\n0.750000 0.749999 0.750000 Mg\n0.500000 0.500000 0.500000 Mg\n0.125000 0.125000 0.125000 Ni\n0.625000 0.125000 0.125000 Ni\n0.125000 0.125000 0.625000 Ni\n0.125000 0.624999 0.125000 Ni\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Mg",
"Ni"
],
"chemical_system": "Mg-Ni",
"density": 6.062763468096582,
"density_atomic": 0.07730330550973467,
"volume": 77.61634461083207,
"volume_molar": 7.790275875384969,
"formula_full": "Mg2 Ni4",
"formula_reduced": "MgNi2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.5404891047619049,
"spacegroup": 227
},
{
"id": "jvasp-107466",
"created_at": "2022-09-04T14:36:56.635714Z",
"updated_at": "2022-09-04T14:36:56.635733Z",
"structure_string": "Na1 Cd3\n1.0\n4.111285 -0.317243 -3.267949\n-1.152857 3.959070 -3.267949\n0.257712 0.317243 5.245545\nNa Cd\n1 3\ndirect\n0.000000 0.000000 0.000000 Na\n0.750000 0.250000 0.500001 Cd\n0.249999 0.750000 0.500000 Cd\n0.500000 0.500000 0.000000 Cd\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Na",
"Cd"
],
"chemical_system": "Cd-Na",
"density": 6.4651331060564665,
"density_atomic": 0.04323318227560408,
"volume": 92.52152604683805,
"volume_molar": 13.929441329601628,
"formula_full": "Na1 Cd3",
"formula_reduced": "NaCd3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 139
},
{
"id": "jvasp-107467",
"created_at": "2022-09-04T14:36:59.702992Z",
"updated_at": "2022-09-04T14:36:59.703011Z",
"structure_string": "Na2 Hg6\n1.0\n6.692038 0.000000 0.000000\n-3.346019 5.795475 0.000000\n0.000000 -0.000000 5.225918\nNa Hg\n2 6\ndirect\n0.666667 0.333334 0.250000 Na\n0.333334 0.666667 0.750000 Na\n0.832301 0.167700 0.750000 Hg\n0.335399 0.167700 0.750000 Hg\n0.832301 0.664602 0.750000 Hg\n0.167700 0.832301 0.250000 Hg\n0.664601 0.832301 0.250000 Hg\n0.167700 0.335399 0.250000 Hg\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Na",
"Hg"
],
"chemical_system": "Hg-Na",
"density": 10.237222037934234,
"density_atomic": 0.039471166458856365,
"volume": 202.6795941877972,
"volume_molar": 15.257063067232407,
"formula_full": "Na2 Hg6",
"formula_reduced": "NaHg3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 194
},
{
"id": "jvasp-107468",
"created_at": "2022-09-04T14:36:56.458369Z",
"updated_at": "2022-09-04T14:36:56.458391Z",
"structure_string": "Nd1 Pu3\n1.0\n4.398235 -0.036399 -3.973333\n-0.891955 4.306995 -3.973333\n0.029885 0.036399 5.927137\nNd Pu\n1 3\ndirect\n0.000000 0.000000 0.000000 Nd\n0.749999 0.250000 0.500000 Pu\n0.250000 0.750001 0.500001 Pu\n0.500000 0.500000 0.000001 Pu\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Nd",
"Pu"
],
"chemical_system": "Nd-Pu",
"density": 12.834699301579443,
"density_atomic": 0.03528357044428169,
"volume": 113.3672116974848,
"volume_molar": 17.067832660274302,
"formula_full": "Nd1 Pu3",
"formula_reduced": "NdPu3",
"formula_anonymous": "AB3",
"energy_above_hull": 6.383687875,
"spacegroup": 139
},
{
"id": "jvasp-107469",
"created_at": "2022-09-04T14:36:59.312291Z",
"updated_at": "2022-09-04T14:36:59.312311Z",
"structure_string": "Pm2 Cd1 Ga1\n1.0\n4.578453 -0.000000 2.643371\n1.526151 4.316607 2.643371\n-0.000000 -0.000000 5.286742\nPm Cd Ga\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Pm\n0.749999 0.750001 0.750000 Pm\n0.499999 0.500000 0.500000 Cd\n0.000000 0.000000 0.000000 Ga\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Pm",
"Cd",
"Ga"
],
"chemical_system": "Cd-Ga-Pm",
"density": 7.503518995591868,
"density_atomic": 0.038283409034218084,
"volume": 104.48390310342428,
"volume_molar": 15.730419291075549,
"formula_full": "Pm2 Cd1 Ga1",
"formula_reduced": "Pm2CdGa",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.09033860625,
"spacegroup": 225
},
{
"id": "jvasp-10747",
"created_at": "2022-09-04T14:37:10.589553Z",
"updated_at": "2022-09-04T14:37:10.589583Z",
"structure_string": "Mg2 Co4 O8\n1.0\n5.103042 -0.000000 -2.679162\n-1.406594 4.905358 -2.679162\n-0.235083 -0.311966 5.751737\nMg Co O\n2 4 8\ndirect\n0.375001 0.625000 0.750001 Mg\n0.625000 0.375000 0.250001 Mg\n0.000000 -0.000000 0.500000 Co\n0.000000 0.500000 0.000001 Co\n0.500000 -0.000000 0.500000 Co\n0.000000 0.000000 0.000000 Co\n0.764209 0.792439 0.528418 O\n0.764025 0.235791 0.971584 O\n0.207561 0.235791 0.971584 O\n0.235792 0.207560 0.471584 O\n0.235793 0.764025 0.471584 O\n0.235976 0.764208 0.028418 O\n0.764208 0.235975 0.528417 O\n0.792440 0.764208 0.028418 O\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Mg",
"Co",
"O"
],
"chemical_system": "Co-Mg-O",
"density": 5.0550792021360955,
"density_atomic": 0.10336025298039542,
"volume": 135.44858488935213,
"volume_molar": 5.826360313903483,
"formula_full": "Mg2 Co4 O8",
"formula_reduced": "Mg(CoO2)2",
"formula_anonymous": "AB2C4",
"energy_above_hull": 2.25502355,
"spacegroup": 227
},
{
"id": "jvasp-107470",
"created_at": "2022-09-04T14:36:56.456690Z",
"updated_at": "2022-09-04T14:36:56.456711Z",
"structure_string": "Pm1 Ho1 Ru2\n1.0\n4.196460 -0.000000 2.422827\n1.398820 3.956461 2.422827\n-0.000000 -0.000000 4.845655\nPm Ho Ru\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Pm\n0.500000 0.500000 0.500000 Ho\n0.250000 0.250000 0.250000 Ru\n0.750000 0.750000 0.750000 Ru\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Pm",
"Ho",
"Ru"
],
"chemical_system": "Ho-Pm-Ru",
"density": 10.569056874176757,
"density_atomic": 0.049718443528407236,
"volume": 80.45304148981558,
"volume_molar": 12.112488510544738,
"formula_full": "Pm1 Ho1 Ru2",
"formula_reduced": "PmHoRu2",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.9178769354166665,
"spacegroup": 225
},
{
"id": "jvasp-107471",
"created_at": "2022-09-04T14:36:56.532182Z",
"updated_at": "2022-09-04T14:36:56.532196Z",
"structure_string": "Pm1 I1\n1.0\n3.898691 -0.000000 0.000000\n-1.949345 3.376366 0.000000\n-0.000000 -0.000000 4.745225\nPm I\n1 1\ndirect\n0.333335 0.666668 -0.000000 Pm\n0.666667 0.333334 0.500001 I\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Pm",
"I"
],
"chemical_system": "I-Pm",
"density": 7.228368774640067,
"density_atomic": 0.03201878530434923,
"volume": 62.46333147835976,
"volume_molar": 18.80814872506107,
"formula_full": "Pm1 I1",
"formula_reduced": "PmI",
"formula_anonymous": "AB",
"energy_above_hull": 0.053253725,
"spacegroup": 187
},
{
"id": "jvasp-107474",
"created_at": "2022-09-04T14:36:59.918367Z",
"updated_at": "2022-09-04T14:36:59.918395Z",
"structure_string": "Rb1 Rh1 O3\n1.0\n3.996540 -0.000000 0.000000\n0.000000 3.996540 0.000000\n-0.000000 -0.000000 3.996540\nRb Rh O\n1 1 3\ndirect\n0.000000 0.000000 0.000000 Rb\n0.500000 0.500000 0.500000 Rh\n0.500000 0.500000 -0.000000 O\n0.500000 0.000000 0.500000 O\n-0.000000 0.500000 0.500000 O\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Rb",
"Rh",
"O"
],
"chemical_system": "O-Rb-Rh",
"density": 6.14881910590957,
"density_atomic": 0.07832808561176204,
"volume": 63.83406361777826,
"volume_molar": 7.688354327781111,
"formula_full": "Rb1 Rh1 O3",
"formula_reduced": "RbRhO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.7643126999999996,
"spacegroup": 221
}
]
}