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=-energy_above_hull&page=4192",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-energy_above_hull&page=4190",
"results": [
{
"id": "jvasp-19699",
"created_at": "2022-09-04T14:37:48.700786Z",
"updated_at": "2022-09-04T14:37:48.700808Z",
"structure_string": "Cd2 Au2\n1.0\n3.236520 0.000000 0.000000\n0.000000 4.817952 -0.000000\n0.000000 -0.000000 4.956074\nCd Au\n2 2\ndirect\n0.000000 0.750000 0.298312 Cd\n0.000000 0.250000 0.701687 Cd\n0.500000 0.750000 0.803431 Au\n0.500000 0.250000 0.196568 Au\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Cd",
"Au"
],
"chemical_system": "Au-Cd",
"density": 13.295031462731341,
"density_atomic": 0.051758471801079696,
"volume": 77.28203443434276,
"volume_molar": 11.635082239569478,
"formula_full": "Cd2 Au2",
"formula_reduced": "CdAu",
"formula_anonymous": "AB",
"energy_above_hull": 0.0056599999999999,
"spacegroup": 51
},
{
"id": "jvasp-4340",
"created_at": "2022-09-04T14:36:34.897351Z",
"updated_at": "2022-09-04T14:36:34.897397Z",
"structure_string": "Cd2 Au2\n1.0\n3.236526 0.000000 0.000000\n0.000000 4.817950 -0.000000\n0.000000 0.000000 4.956070\nCd Au\n2 2\ndirect\n0.000000 0.250000 0.298312 Cd\n0.000000 0.750000 0.701688 Cd\n0.500001 0.250000 0.803431 Au\n0.500001 0.750000 0.196569 Au\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Cd",
"Au"
],
"chemical_system": "Au-Cd",
"density": 13.295023065109572,
"density_atomic": 0.05175843910856063,
"volume": 77.28208324849612,
"volume_molar": 11.635089588712042,
"formula_full": "Cd2 Au2",
"formula_reduced": "CdAu",
"formula_anonymous": "AB",
"energy_above_hull": 0.0056599999999999,
"spacegroup": 51
},
{
"id": "jvasp-66362",
"created_at": "2022-09-04T14:36:19.345488Z",
"updated_at": "2022-09-04T14:36:19.345520Z",
"structure_string": "Ba1 Tl1 Br1\n1.0\n0.000000 3.991120 3.991120\n3.991120 0.000000 3.991120\n3.991120 3.991120 -0.000000\nBa Tl Br\n1 1 1\ndirect\n0.750000 0.750000 0.750000 Ba\n0.500000 0.500000 0.500000 Tl\n0.000000 0.000000 0.000000 Br\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ba",
"Tl",
"Br"
],
"chemical_system": "Ba-Br-Tl",
"density": 5.506175845425353,
"density_atomic": 0.02359428937912389,
"volume": 127.14941110514586,
"volume_molar": 25.523721707543185,
"formula_full": "Ba1 Tl1 Br1",
"formula_reduced": "BaTlBr",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0056428855555555,
"spacegroup": 216
},
{
"id": "jvasp-99576",
"created_at": "2022-09-04T14:36:22.677873Z",
"updated_at": "2022-09-04T14:36:22.677890Z",
"structure_string": "Zn1 Hg1 Te2\n1.0\n4.334838 0.009407 6.545737\n1.977903 3.857306 6.545737\n0.015357 0.009407 7.850941\nZn Hg Te\n1 1 2\ndirect\n0.498969 0.498970 0.498969 Zn\n0.002154 0.002154 0.002154 Hg\n0.129917 0.129918 0.129917 Te\n0.618960 0.618962 0.618960 Te\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Zn",
"Hg",
"Te"
],
"chemical_system": "Hg-Te-Zn",
"density": 6.627089897326187,
"density_atomic": 0.03062881410337628,
"volume": 130.59598019366578,
"volume_molar": 19.661684385410684,
"formula_full": "Zn1 Hg1 Te2",
"formula_reduced": "ZnHgTe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0056075,
"spacegroup": 160
},
{
"id": "jvasp-94806",
"created_at": "2022-09-04T14:36:01.731963Z",
"updated_at": "2022-09-04T14:36:01.731991Z",
"structure_string": "K1 Sr1 Mg6\n1.0\n7.523481 -0.161598 0.000000\n-3.901689 6.757925 0.000000\n0.000000 0.000000 5.094242\nK Sr Mg\n1 1 6\ndirect\n0.085786 0.292892 0.250000 K\n0.248357 0.874177 0.250000 Sr\n0.670563 0.388248 0.250000 Mg\n0.670562 0.782315 0.250000 Mg\n0.396016 0.252035 0.750000 Mg\n0.396016 0.643982 0.750000 Mg\n0.678914 0.089458 0.750000 Mg\n0.853783 0.676890 0.750000 Mg\n",
"nsites": 8,
"nelements": 3,
"elements": [
"K",
"Sr",
"Mg"
],
"chemical_system": "K-Mg-Sr",
"density": 1.7692946396379405,
"density_atomic": 0.031275018393423185,
"volume": 255.79521327099582,
"volume_molar": 19.255434750651958,
"formula_full": "K1 Sr1 Mg6",
"formula_reduced": "KSrMg6",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.005585,
"spacegroup": 38
},
{
"id": "jvasp-4825",
"created_at": "2022-09-04T14:37:09.813468Z",
"updated_at": "2022-09-04T14:37:09.813486Z",
"structure_string": "Na2 Mg2 F6\n1.0\n3.011974 0.000000 0.000000\n-1.505987 5.018236 0.000000\n0.000000 0.000000 7.382206\nNa Mg F\n2 2 6\ndirect\n0.255781 0.511563 0.009081 Na\n0.744217 0.488437 0.509081 Na\n0.999996 0.999997 0.759109 Mg\n0.000002 0.000003 0.259108 Mg\n0.372665 0.745333 0.701132 F\n0.627333 0.254668 0.201131 F\n0.372670 0.745342 0.317077 F\n0.627329 0.254659 0.817077 F\n0.928152 0.856307 0.009103 F\n0.071846 0.143694 0.509104 F\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Na",
"Mg",
"F"
],
"chemical_system": "F-Mg-Na",
"density": 3.104082192532814,
"density_atomic": 0.08962136200071118,
"volume": 111.58054036180177,
"volume_molar": 6.7195372013563155,
"formula_full": "Na2 Mg2 F6",
"formula_reduced": "NaMgF3",
"formula_anonymous": "ABC3",
"energy_above_hull": 0.0055819999999999,
"spacegroup": 63
},
{
"id": "jvasp-22729",
"created_at": "2022-09-04T14:35:58.417168Z",
"updated_at": "2022-09-04T14:35:58.417189Z",
"structure_string": "Sr2 Sb1 Au1\n1.0\n0.000000 3.930797 3.930797\n3.930797 0.000000 3.930797\n3.930797 3.930797 -0.000000\nSr Sb Au\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Sr\n0.500000 0.500000 0.500000 Sr\n0.750000 0.750000 0.750000 Sb\n0.249999 0.249999 0.249999 Au\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sr",
"Sb",
"Au"
],
"chemical_system": "Au-Sb-Sr",
"density": 6.752658882960004,
"density_atomic": 0.03292972833673902,
"volume": 121.47078649104076,
"volume_molar": 18.28785436192385,
"formula_full": "Sr2 Sb1 Au1",
"formula_reduced": "Sr2SbAu",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0055649999999999,
"spacegroup": 225
},
{
"id": "jvasp-79329",
"created_at": "2022-09-04T14:37:12.878882Z",
"updated_at": "2022-09-04T14:37:12.878913Z",
"structure_string": "Sr2 Sb1 Au1\n1.0\n-0.000000 3.930798 3.930798\n3.930798 -0.000000 3.930798\n3.930798 3.930798 0.000000\nSr Sb Au\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Sr\n0.500000 0.500000 0.500000 Sr\n0.749999 0.749999 0.749999 Sb\n0.249999 0.249999 0.249999 Au\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sr",
"Sb",
"Au"
],
"chemical_system": "Au-Sb-Sr",
"density": 6.752653729306347,
"density_atomic": 0.03292970320465138,
"volume": 121.47087919805463,
"volume_molar": 18.28786831929102,
"formula_full": "Sr2 Sb1 Au1",
"formula_reduced": "Sr2SbAu",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0055649999999999,
"spacegroup": 225
},
{
"id": "jvasp-38735",
"created_at": "2022-09-04T14:38:02.509343Z",
"updated_at": "2022-09-04T14:38:02.509362Z",
"structure_string": "Hg6 Sb2\n1.0\n3.220829 -5.578639 0.000000\n3.220829 5.578639 -0.000000\n-0.000000 -0.000000 5.846656\nHg Sb\n6 2\ndirect\n0.167196 0.334391 0.250000 Hg\n0.665609 0.832805 0.250000 Hg\n0.167196 0.832805 0.250000 Hg\n0.832805 0.665609 0.750001 Hg\n0.334391 0.167196 0.750001 Hg\n0.832805 0.167196 0.750001 Hg\n0.333333 0.666667 0.750001 Sb\n0.666667 0.333333 0.250000 Sb\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Hg",
"Sb"
],
"chemical_system": "Hg-Sb",
"density": 11.436737998919542,
"density_atomic": 0.03807645631199009,
"volume": 210.1035856501394,
"volume_molar": 15.815917087073196,
"formula_full": "Hg6 Sb2",
"formula_reduced": "Hg3Sb",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0055525,
"spacegroup": 194
},
{
"id": "jvasp-102128",
"created_at": "2022-09-04T14:38:39.928896Z",
"updated_at": "2022-09-04T14:38:39.928917Z",
"structure_string": "Sr3\n1.0\n4.121314 -0.000275 9.789777\n1.976428 3.616484 9.789777\n-0.000464 -0.000275 10.621909\nSr\n3\ndirect\n0.000000 0.000000 0.000000 Sr\n0.222379 0.222377 0.222378 Sr\n0.777624 0.777619 0.777623 Sr\n",
"nsites": 3,
"nelements": 1,
"elements": [
"Sr"
],
"chemical_system": "Sr",
"density": 2.756589091484692,
"density_atomic": 0.018946093965005854,
"volume": 158.34398401808375,
"volume_molar": 31.78565867520302,
"formula_full": "Sr3",
"formula_reduced": "Sr",
"formula_anonymous": "A",
"energy_above_hull": 0.0055499999999999,
"spacegroup": 166
},
{
"id": "jvasp-3618",
"created_at": "2022-09-04T14:35:46.894823Z",
"updated_at": "2022-09-04T14:35:46.894841Z",
"structure_string": "Ba2 Br2 F2\n1.0\n4.527869 0.000000 0.000000\n0.000000 4.527869 0.000000\n0.000000 0.000000 7.480885\nBa Br F\n2 2 2\ndirect\n0.000000 0.500000 0.806384 Ba\n0.500000 0.000000 0.193616 Ba\n0.500000 0.000000 0.648767 Br\n0.000000 0.500000 0.351233 Br\n0.500000 0.500000 0.000000 F\n0.000000 0.000000 0.000000 F\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Br",
"F"
],
"chemical_system": "Ba-Br-F",
"density": 5.115314739753813,
"density_atomic": 0.03912105561947992,
"volume": 153.3700945690321,
"volume_molar": 15.393604964487048,
"formula_full": "Ba2 Br2 F2",
"formula_reduced": "BaBrF",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0055466666666668,
"spacegroup": 129
},
{
"id": "jvasp-1603",
"created_at": "2022-09-04T14:36:53.611696Z",
"updated_at": "2022-09-04T14:36:53.611735Z",
"structure_string": "K2 Se1\n1.0\n4.681044 0.000000 2.702602\n1.560348 4.413330 2.702602\n-0.000000 -0.000000 5.405203\nK Se\n2 1\ndirect\n0.750000 0.750000 0.749999 K\n0.250000 0.250000 0.250000 K\n0.000000 0.000000 0.000000 Se\n",
"nsites": 3,
"nelements": 2,
"elements": [
"K",
"Se"
],
"chemical_system": "K-Se",
"density": 2.3370100882266485,
"density_atomic": 0.02686582118798288,
"volume": 111.66604508414967,
"volume_molar": 22.41562138697518,
"formula_full": "K2 Se1",
"formula_reduced": "K2Se",
"formula_anonymous": "AB2",
"energy_above_hull": 0.0055366666666666,
"spacegroup": 225
}
]
}