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{
"id": "jvasp-68072",
"created_at": "2022-09-04T14:35:59.822955Z",
"updated_at": "2022-09-04T14:35:59.822980Z",
"structure_string": "Sr1 Be1 Tc2\n1.0\n-2.285538 2.285538 3.232109\n2.285538 -2.285538 3.232109\n2.285538 2.285538 -3.232109\nSr Be Tc\n1 1 2\ndirect\n0.750001 0.250000 0.500000 Sr\n0.500000 0.500000 0.000000 Be\n0.000000 0.000000 0.000000 Tc\n0.250000 0.750001 0.500000 Tc\n",
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"elements": [
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"chemical_system": "Be-Sr-Tc",
"density": 7.195289965911314,
"density_atomic": 0.059229369377709555,
"volume": 67.53406362461398,
"volume_molar": 10.167490931055529,
"formula_full": "Sr1 Be1 Tc2",
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{
"id": "jvasp-71095",
"created_at": "2022-09-04T14:36:17.424457Z",
"updated_at": "2022-09-04T14:36:17.424495Z",
"structure_string": "Sr1 Be1 Tc1\n1.0\n1.967468 -3.407754 0.000000\n1.967468 3.407754 -0.000000\n-0.000000 0.000000 4.757362\nSr Be Tc\n1 1 1\ndirect\n0.666667 0.333334 0.327876 Sr\n0.000000 0.000000 0.860128 Be\n0.333334 0.666667 0.811996 Tc\n",
"nsites": 3,
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"density": 5.066308602530522,
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"volume": 63.79286521692975,
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"formula_full": "Sr1 Be1 Tc1",
"formula_reduced": "SrBeTc",
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"spacegroup": 156
},
{
"id": "jvasp-65266",
"created_at": "2022-09-04T14:35:47.876059Z",
"updated_at": "2022-09-04T14:35:47.876069Z",
"structure_string": "Sr1 Be1 Sn4\n1.0\n-0.000000 4.416854 4.416854\n4.416854 0.000000 4.416854\n4.416854 4.416854 0.000000\nSr Be Sn\n1 1 4\ndirect\n0.250000 0.250000 0.250000 Sr\n0.000000 0.000000 0.000000 Be\n0.124433 0.625188 0.625188 Sn\n0.625188 0.625188 0.625188 Sn\n0.625188 0.124433 0.625188 Sn\n0.625188 0.625188 0.124433 Sn\n",
"nsites": 6,
"nelements": 3,
"elements": [
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],
"chemical_system": "Be-Sn-Sr",
"density": 5.506492666132907,
"density_atomic": 0.03481626051308276,
"volume": 172.3332693281464,
"volume_molar": 17.296920092084804,
"formula_full": "Sr1 Be1 Sn4",
"formula_reduced": "SrBeSn4",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.5725648683333333,
"spacegroup": 216
},
{
"id": "jvasp-70928",
"created_at": "2022-09-04T14:36:01.144523Z",
"updated_at": "2022-09-04T14:36:01.144554Z",
"structure_string": "Sr1 Be1 Si4\n1.0\n-0.000000 3.786790 3.786790\n3.786790 0.000000 3.786790\n3.786790 3.786790 -0.000000\nSr Be Si\n1 1 4\ndirect\n0.250000 0.250000 0.250000 Sr\n0.000000 0.000000 0.000000 Be\n0.116119 0.627960 0.627960 Si\n0.627960 0.627960 0.627960 Si\n0.627960 0.116119 0.627960 Si\n0.627960 0.627960 0.116119 Si\n",
"nsites": 6,
"nelements": 3,
"elements": [
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"Be",
"Si"
],
"chemical_system": "Be-Si-Sr",
"density": 3.195200172576417,
"density_atomic": 0.05524685877879713,
"volume": 108.60345968308167,
"volume_molar": 10.900422020575046,
"formula_full": "Sr1 Be1 Si4",
"formula_reduced": "SrBeSi4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.615734468333333,
"spacegroup": 216
},
{
"id": "jvasp-103684",
"created_at": "2022-09-04T14:36:49.240389Z",
"updated_at": "2022-09-04T14:36:49.240425Z",
"structure_string": "Sr1 Be1 Si1\n1.0\n4.007874 -0.000000 0.000000\n-2.003937 3.470921 0.000000\n0.000000 -0.000000 4.604127\nSr Be Si\n1 1 1\ndirect\n0.333332 0.666666 -0.000000 Sr\n0.666666 0.333333 0.500000 Be\n0.000000 0.000000 0.500000 Si\n",
"nsites": 3,
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"elements": [
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],
"chemical_system": "Be-Si-Sr",
"density": 3.233486444059585,
"density_atomic": 0.04683981502737031,
"volume": 64.04807530189828,
"volume_molar": 12.856884162503698,
"formula_full": "Sr1 Be1 Si1",
"formula_reduced": "SrBeSi",
"formula_anonymous": "ABC",
"energy_above_hull": 1.1753903366666665,
"spacegroup": 187
},
{
"id": "jvasp-74226",
"created_at": "2022-09-04T14:35:50.295659Z",
"updated_at": "2022-09-04T14:35:50.295677Z",
"structure_string": "Sr1 Be1 Se2\n1.0\n-2.508081 2.508081 3.547086\n2.508081 -2.508081 3.547086\n2.508081 2.508081 -3.547086\nSr Be Se\n1 1 2\ndirect\n0.250000 0.750000 0.500000 Sr\n0.750000 0.250000 0.500000 Be\n0.000000 0.000000 0.000000 Se\n0.500001 0.500001 0.000000 Se\n",
"nsites": 4,
"nelements": 3,
"elements": [
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],
"chemical_system": "Be-Se-Sr",
"density": 4.735993478668856,
"density_atomic": 0.044817245961524844,
"volume": 89.25135657451955,
"volume_molar": 13.437105807817703,
"formula_full": "Sr1 Be1 Se2",
"formula_reduced": "SrBeSe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.8788847858333331,
"spacegroup": 225
},
{
"id": "jvasp-69726",
"created_at": "2022-09-04T14:36:01.570702Z",
"updated_at": "2022-09-04T14:36:01.570729Z",
"structure_string": "Sr1 Be1 Sb1\n1.0\n2.119025 -3.670260 0.000000\n2.119025 3.670260 -0.000000\n0.000000 -0.000000 4.767839\nSr Be Sb\n1 1 1\ndirect\n0.666668 0.333334 0.333381 Sr\n0.000000 0.000000 0.833160 Be\n0.333334 0.666668 0.833459 Sb\n",
"nsites": 3,
"nelements": 3,
"elements": [
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"Sb"
],
"chemical_system": "Be-Sb-Sr",
"density": 4.889919350653901,
"density_atomic": 0.04045169892326382,
"volume": 74.16252171981574,
"volume_molar": 14.887238163776257,
"formula_full": "Sr1 Be1 Sb1",
"formula_reduced": "SrBeSb",
"formula_anonymous": "ABC",
"energy_above_hull": 0.6743228366666667,
"spacegroup": 187
},
{
"id": "jvasp-67796",
"created_at": "2022-09-04T14:36:18.875063Z",
"updated_at": "2022-09-04T14:36:18.875088Z",
"structure_string": "Sr1 Be1 Sb1\n1.0\n-1.836949 1.836949 5.596470\n1.836949 -1.836949 5.596470\n1.836949 1.836949 -5.596470\nSr Be Sb\n1 1 1\ndirect\n0.664937 0.664937 0.000000 Sr\n0.958972 0.958972 0.000000 Be\n0.376092 0.376092 0.000000 Sb\n",
"nsites": 3,
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"elements": [
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],
"chemical_system": "Be-Sb-Sr",
"density": 4.800846448251229,
"density_atomic": 0.039714846232690844,
"volume": 75.53850221206655,
"volume_molar": 15.16344977068787,
"formula_full": "Sr1 Be1 Sb1",
"formula_reduced": "SrBeSb",
"formula_anonymous": "ABC",
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"spacegroup": 107
},
{
"id": "jvasp-67740",
"created_at": "2022-09-04T14:35:52.254950Z",
"updated_at": "2022-09-04T14:35:52.254977Z",
"structure_string": "Sr1 Be1 Rh1\n1.0\n-1.605679 1.605679 5.363983\n1.605679 -1.605679 5.363983\n1.605679 1.605679 -5.363983\nSr Be Rh\n1 1 1\ndirect\n0.667642 0.667642 0.000000 Sr\n0.941204 0.941204 0.000000 Be\n0.391154 0.391154 0.000000 Rh\n",
"nsites": 3,
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"elements": [
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"Be",
"Rh"
],
"chemical_system": "Be-Rh-Sr",
"density": 5.989756689480461,
"density_atomic": 0.05423209925030857,
"volume": 55.31779225719223,
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"formula_full": "Sr1 Be1 Rh1",
"formula_reduced": "SrBeRh",
"formula_anonymous": "ABC",
"energy_above_hull": 1.1618618033333332,
"spacegroup": 107
},
{
"id": "jvasp-67845",
"created_at": "2022-09-04T14:35:58.545265Z",
"updated_at": "2022-09-04T14:35:58.545293Z",
"structure_string": "Sr1 Be1 Re1\n1.0\n-1.622175 1.622175 5.439588\n1.622175 -1.622175 5.439588\n1.622175 1.622175 -5.439588\nSr Be Re\n1 1 1\ndirect\n0.673049 0.673049 0.000000 Sr\n0.934632 0.934632 0.000000 Be\n0.392320 0.392320 0.000000 Re\n",
"nsites": 3,
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"elements": [
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"Re"
],
"chemical_system": "Be-Re-Sr",
"density": 8.202897099165032,
"density_atomic": 0.0523962068890852,
"volume": 57.25605302594792,
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"formula_full": "Sr1 Be1 Re1",
"formula_reduced": "SrBeRe",
"formula_anonymous": "ABC",
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"spacegroup": 107
},
{
"id": "jvasp-67738",
"created_at": "2022-09-04T14:35:49.022455Z",
"updated_at": "2022-09-04T14:35:49.022482Z",
"structure_string": "Sr1 Be1 Pd1\n1.0\n-1.652314 1.652314 5.391135\n1.652314 -1.652314 5.391135\n1.652314 1.652314 -5.391135\nSr Be Pd\n1 1 1\ndirect\n0.667248 0.667248 0.000000 Sr\n0.944593 0.944593 0.000000 Be\n0.388161 0.388161 0.000000 Pd\n",
"nsites": 3,
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"elements": [
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],
"chemical_system": "Be-Pd-Sr",
"density": 5.727055534915155,
"density_atomic": 0.0509560659390228,
"volume": 58.874246759747635,
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"formula_full": "Sr1 Be1 Pd1",
"formula_reduced": "SrBePd",
"formula_anonymous": "ABC",
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"spacegroup": 107
},
{
"id": "jvasp-70805",
"created_at": "2022-09-04T14:36:07.944296Z",
"updated_at": "2022-09-04T14:36:07.944326Z",
"structure_string": "Sr1 Be1 Pb4\n1.0\n0.000000 4.586316 4.586316\n4.586316 0.000000 4.586316\n4.586316 4.586316 0.000000\nSr Be Pb\n1 1 4\ndirect\n0.250000 0.250000 0.250000 Sr\n0.000000 0.000000 0.000000 Be\n0.125601 0.624800 0.624800 Pb\n0.624800 0.624800 0.624800 Pb\n0.624800 0.125601 0.624800 Pb\n0.624800 0.624800 0.125601 Pb\n",
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],
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"density": 7.964743169124054,
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"volume": 192.9398423865168,
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"formula_full": "Sr1 Be1 Pb4",
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"formula_anonymous": "ABC4",
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}
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