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{
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"next": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-chemical_system&page=179",
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"results": [
{
"id": "jvasp-38367",
"created_at": "2022-09-04T14:37:53.332230Z",
"updated_at": "2022-09-04T14:37:53.332256Z",
"structure_string": "Pu3 Sc1\n1.0\n0.000000 3.478651 3.478651\n3.478651 0.000000 3.478651\n3.478651 3.478651 0.000000\nPu Sc\n3 1\ndirect\n0.000000 0.000000 0.000000 Pu\n0.500000 0.500000 0.500000 Pu\n0.250000 0.250000 0.250000 Pu\n0.750000 0.750000 0.750000 Sc\n",
"nsites": 4,
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"elements": [
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"chemical_system": "Pu-Sc",
"density": 15.32437948439738,
"density_atomic": 0.047511354979734896,
"volume": 84.19040041493507,
"volume_molar": 12.675161048487535,
"formula_full": "Pu3 Sc1",
"formula_reduced": "Pu3Sc",
"formula_anonymous": "AB3",
"energy_above_hull": 6.6905463125,
"spacegroup": 225
},
{
"id": "jvasp-4969",
"created_at": "2022-09-04T14:38:35.530003Z",
"updated_at": "2022-09-04T14:38:35.530023Z",
"structure_string": "Pu1 Sb1\n1.0\n3.598063 -0.000000 -0.000000\n-0.000000 3.598063 0.000000\n-0.000000 -0.000000 4.097430\nPu Sb\n1 1\ndirect\n0.000000 0.000000 0.000000 Pu\n0.500000 0.500000 0.500000 Sb\n",
"nsites": 2,
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"elements": [
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],
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"density": 11.449756129806525,
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"volume": 53.04556377567833,
"volume_molar": 15.9723925875346,
"formula_full": "Pu1 Sb1",
"formula_reduced": "PuSb",
"formula_anonymous": "AB",
"energy_above_hull": 2.90113305,
"spacegroup": 123
},
{
"id": "jvasp-17554",
"created_at": "2022-09-04T14:38:30.792909Z",
"updated_at": "2022-09-04T14:38:30.792926Z",
"structure_string": "Pu1 Sb1\n1.0\n3.598046 -0.000000 0.000000\n-0.000000 3.598046 0.000000\n-0.000000 0.000000 4.097518\nPu Sb\n1 1\ndirect\n0.000000 0.000000 0.000000 Pu\n0.500001 0.500001 0.500000 Sb\n",
"nsites": 2,
"nelements": 2,
"elements": [
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],
"chemical_system": "Pu-Sb",
"density": 11.449618423327582,
"density_atomic": 0.0377029821836155,
"volume": 53.04620176356064,
"volume_molar": 15.972584690176122,
"formula_full": "Pu1 Sb1",
"formula_reduced": "PuSb",
"formula_anonymous": "AB",
"energy_above_hull": 2.90113305,
"spacegroup": 123
},
{
"id": "jvasp-18025",
"created_at": "2022-09-04T14:38:15.817631Z",
"updated_at": "2022-09-04T14:38:15.817655Z",
"structure_string": "Pu1 Sb1\n1.0\n3.767890 -0.000000 0.000000\n0.000000 3.767890 0.000000\n-0.000000 0.000000 3.767890\nPu Sb\n1 1\ndirect\n0.000000 0.000000 0.000000 Pu\n0.500000 0.500000 0.500000 Sb\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Pu",
"Sb"
],
"chemical_system": "Pu-Sb",
"density": 11.354046269683806,
"density_atomic": 0.03738826818417431,
"volume": 53.49271568685707,
"volume_molar": 16.107033175045668,
"formula_full": "Pu1 Sb1",
"formula_reduced": "PuSb",
"formula_anonymous": "AB",
"energy_above_hull": 2.91117805,
"spacegroup": 221
},
{
"id": "jvasp-78770",
"created_at": "2022-09-04T14:36:36.109778Z",
"updated_at": "2022-09-04T14:36:36.109793Z",
"structure_string": "Pu1 Sb1\n1.0\n3.767881 -0.000000 -0.000000\n-0.000000 3.767881 -0.000000\n0.000000 -0.000000 3.767881\nPu Sb\n1 1\ndirect\n0.000000 0.000000 0.000000 Pu\n0.500000 0.500000 0.500000 Sb\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Pu",
"Sb"
],
"chemical_system": "Pu-Sb",
"density": 11.354127631059479,
"density_atomic": 0.03738853610284059,
"volume": 53.49233236890626,
"volume_molar": 16.106917755312885,
"formula_full": "Pu1 Sb1",
"formula_reduced": "PuSb",
"formula_anonymous": "AB",
"energy_above_hull": 2.91117305,
"spacegroup": 221
},
{
"id": "jvasp-85610",
"created_at": "2022-09-04T14:36:07.288408Z",
"updated_at": "2022-09-04T14:36:07.288424Z",
"structure_string": "Pu2 S4\n1.0\n3.936544 0.000000 -0.000000\n0.000000 3.936544 0.000000\n-0.000000 0.000000 7.712791\nPu S\n2 4\ndirect\n0.000000 0.000000 0.001576 Pu\n0.500000 0.500000 0.462424 Pu\n0.500000 0.500000 0.093829 S\n0.000000 0.500000 0.732000 S\n0.500000 0.000000 0.732000 S\n0.000000 0.000000 0.370171 S\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Pu",
"S"
],
"chemical_system": "Pu-S",
"density": 8.561922529073811,
"density_atomic": 0.05020066465204566,
"volume": 119.5203298917976,
"volume_molar": 11.996137504834012,
"formula_full": "Pu2 S4",
"formula_reduced": "PuS2",
"formula_anonymous": "AB2",
"energy_above_hull": 2.9443566666666663,
"spacegroup": 129
},
{
"id": "jvasp-20387",
"created_at": "2022-09-04T14:37:36.585151Z",
"updated_at": "2022-09-04T14:37:36.585178Z",
"structure_string": "Pu1 S1\n1.0\n3.427725 -0.000000 1.978998\n1.142575 3.231690 1.978998\n-0.000000 -0.000000 3.957995\nPu S\n1 1\ndirect\n0.000000 0.000000 0.000000 Pu\n0.500001 0.500000 0.500000 S\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Pu",
"S"
],
"chemical_system": "Pu-S",
"density": 10.455613945839756,
"density_atomic": 0.04561619831258975,
"volume": 43.84407456085647,
"volume_molar": 13.201759424870643,
"formula_full": "Pu1 S1",
"formula_reduced": "PuS",
"formula_anonymous": "AB",
"energy_above_hull": 2.3487649999999998,
"spacegroup": 225
},
{
"id": "jvasp-20574",
"created_at": "2022-09-04T14:38:10.861861Z",
"updated_at": "2022-09-04T14:38:10.861872Z",
"structure_string": "Pu1 S1\n1.0\n3.427725 -0.000000 1.978998\n1.142575 3.231690 1.978998\n0.000000 0.000000 3.957995\nPu S\n1 1\ndirect\n0.000000 0.000000 0.000000 Pu\n0.500001 0.500000 0.500000 S\n",
"nsites": 2,
"nelements": 2,
"elements": [
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"S"
],
"chemical_system": "Pu-S",
"density": 10.455613945839756,
"density_atomic": 0.04561619831258975,
"volume": 43.84407456085647,
"volume_molar": 13.201759424870643,
"formula_full": "Pu1 S1",
"formula_reduced": "PuS",
"formula_anonymous": "AB",
"energy_above_hull": 2.3487649999999998,
"spacegroup": 225
},
{
"id": "jvasp-16611",
"created_at": "2022-09-04T14:37:27.899938Z",
"updated_at": "2022-09-04T14:37:27.899947Z",
"structure_string": "Pu1 Ru1\n1.0\n3.272043 0.000000 0.000000\n0.000000 3.272043 0.000000\n-0.000000 0.000000 3.272043\nPu Ru\n1 1\ndirect\n0.000000 0.000000 0.000000 Pu\n0.500000 0.500000 0.500000 Ru\n",
"nsites": 2,
"nelements": 2,
"elements": [
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"Ru"
],
"chemical_system": "Pu-Ru",
"density": 16.3568358076567,
"density_atomic": 0.05709170177410817,
"volume": 35.031360738085866,
"volume_molar": 10.54818926895453,
"formula_full": "Pu1 Ru1",
"formula_reduced": "PuRu",
"formula_anonymous": "AB",
"energy_above_hull": 4.333500249999998,
"spacegroup": 221
},
{
"id": "jvasp-16612",
"created_at": "2022-09-04T14:37:57.467217Z",
"updated_at": "2022-09-04T14:37:57.467240Z",
"structure_string": "Pu2 Ru4\n1.0\n4.510549 -0.000000 2.604167\n1.503517 4.252586 2.604167\n-0.000000 0.000000 5.208333\nPu Ru\n2 4\ndirect\n0.125000 0.125000 0.125000 Pu\n0.875001 0.875001 0.875000 Pu\n0.500000 0.000000 0.500000 Ru\n0.000000 0.500001 0.500000 Ru\n0.500000 0.500001 0.500000 Ru\n0.500000 0.500001 0.000000 Ru\n",
"nsites": 6,
"nelements": 2,
"elements": [
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"Ru"
],
"chemical_system": "Pu-Ru",
"density": 14.83095107920674,
"density_atomic": 0.060057879836725205,
"volume": 99.9036265734279,
"volume_molar": 10.027228360994322,
"formula_full": "Pu2 Ru4",
"formula_reduced": "PuRu2",
"formula_anonymous": "AB2",
"energy_above_hull": 5.094077,
"spacegroup": 227
},
{
"id": "jvasp-100502",
"created_at": "2022-09-04T14:36:55.759918Z",
"updated_at": "2022-09-04T14:36:55.759949Z",
"structure_string": "Pu3 Ru1\n1.0\n3.644526 0.271684 -4.661597\n-0.221948 3.647892 -4.661597\n-0.237234 -0.271684 5.912424\nPu Ru\n3 1\ndirect\n0.750003 0.250000 0.500002 Pu\n0.250000 0.750002 0.500001 Pu\n0.499999 0.499998 -0.000001 Pu\n0.000000 0.000000 0.000000 Ru\n",
"nsites": 4,
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"elements": [
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"Ru"
],
"chemical_system": "Pu-Ru",
"density": 19.66915192896447,
"density_atomic": 0.05687416499789141,
"volume": 70.33070287973983,
"volume_molar": 10.588534812288266,
"formula_full": "Pu3 Ru1",
"formula_reduced": "Pu3Ru",
"formula_anonymous": "AB3",
"energy_above_hull": 7.151055125,
"spacegroup": 139
},
{
"id": "jvasp-20494",
"created_at": "2022-09-04T14:37:46.025682Z",
"updated_at": "2022-09-04T14:37:46.025703Z",
"structure_string": "Pu2 Rh4\n1.0\n4.521849 0.000000 2.610691\n1.507283 4.263240 2.610691\n0.000000 0.000000 5.221382\nPu Rh\n2 4\ndirect\n0.125000 0.125000 0.125000 Pu\n0.875000 0.875000 0.875000 Pu\n0.500000 -0.000000 0.500000 Rh\n-0.000000 0.500000 0.500000 Rh\n0.500000 0.500000 0.500000 Rh\n0.500000 0.500000 -0.000000 Rh\n",
"nsites": 6,
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"elements": [
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"Rh"
],
"chemical_system": "Pu-Rh",
"density": 14.841160422697026,
"density_atomic": 0.05960874042971973,
"volume": 100.65637953001469,
"volume_molar": 10.10278143202885,
"formula_full": "Pu2 Rh4",
"formula_reduced": "PuRh2",
"formula_anonymous": "AB2",
"energy_above_hull": 4.043148666666667,
"spacegroup": 227
}
]
}