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=-formula_reduced&page=981",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-formula_reduced&page=979",
"results": [
{
"id": "jvasp-111913",
"created_at": "2022-09-04T14:38:49.953864Z",
"updated_at": "2022-09-04T14:38:49.953889Z",
"structure_string": "Sr4 U2 Fe2 O12\n1.0\n5.687881 0.000000 0.000000\n0.000000 4.667668 3.341166\n0.000000 -0.048845 9.868225\nSr U Fe O\n4 2 2 12\ndirect\n0.487885 0.255441 0.247907 Sr\n0.012115 0.255441 0.747908 Sr\n0.512115 0.744558 0.752094 Sr\n0.987885 0.744559 0.252093 Sr\n0.500000 0.000000 0.000000 U\n0.000000 -0.000000 0.500000 U\n0.000000 0.500000 0.000000 Fe\n0.500000 0.500000 0.500001 Fe\n0.723768 0.270602 0.472724 O\n0.242447 0.303607 0.473151 O\n0.996207 0.792411 0.759870 O\n0.496207 0.207588 0.740132 O\n0.276232 0.729398 0.527277 O\n0.223768 0.729398 0.027277 O\n0.257553 0.303606 0.973152 O\n0.776232 0.270601 0.972724 O\n0.003793 0.207588 0.240131 O\n0.757553 0.696393 0.526850 O\n0.742447 0.696393 0.026849 O\n0.503793 0.792412 0.259869 O\n",
"nsites": 20,
"nelements": 4,
"elements": [
"Sr",
"U",
"Fe",
"O"
],
"chemical_system": "Fe-O-Sr-U",
"density": 7.138168685761016,
"density_atomic": 0.07606843451348896,
"volume": 262.9211463061392,
"volume_molar": 7.91674075918062,
"formula_full": "Sr4 U2 Fe2 O12",
"formula_reduced": "Sr2UFeO6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 2.432928512,
"spacegroup": 14
},
{
"id": "jvasp-99646",
"created_at": "2022-09-04T14:36:36.914687Z",
"updated_at": "2022-09-04T14:36:36.914711Z",
"structure_string": "Sr2 U1 Cr1 O6\n1.0\n5.021282 -0.000000 2.899039\n1.673761 4.734111 2.899039\n-0.000000 -0.000000 5.798078\nSr U Cr O\n2 1 1 6\ndirect\n0.250000 0.250000 0.250000 Sr\n0.750000 0.750000 0.750001 Sr\n0.000000 0.000000 0.000000 U\n0.500000 0.500000 0.500001 Cr\n0.739983 0.260017 0.260017 O\n0.260016 0.739983 0.739984 O\n0.260016 0.739982 0.260018 O\n0.739983 0.260017 0.739984 O\n0.260017 0.260017 0.739984 O\n0.739983 0.739983 0.260017 O\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Sr",
"U",
"Cr",
"O"
],
"chemical_system": "Cr-O-Sr-U",
"density": 6.762031319119021,
"density_atomic": 0.07255425674345907,
"volume": 137.82788838094635,
"volume_molar": 8.300189444836274,
"formula_full": "Sr2 U1 Cr1 O6",
"formula_reduced": "Sr2UCrO6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 2.5753907019999995,
"spacegroup": 225
},
{
"id": "jvasp-102291",
"created_at": "2022-09-04T14:36:39.159541Z",
"updated_at": "2022-09-04T14:36:39.159566Z",
"structure_string": "Sr2 Tl1 Zn1\n1.0\n4.869209 -0.000000 2.811239\n1.623070 4.590734 2.811239\n-0.000000 -0.000000 5.622478\nSr Tl Zn\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Sr\n0.750000 0.749999 0.750001 Sr\n0.500000 0.500000 0.500000 Tl\n0.000000 0.000000 0.000000 Zn\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sr",
"Tl",
"Zn"
],
"chemical_system": "Sr-Tl-Zn",
"density": 5.879932224096003,
"density_atomic": 0.03182670518522172,
"volume": 125.68061873578243,
"volume_molar": 18.921659420769377,
"formula_full": "Sr2 Tl1 Zn1",
"formula_reduced": "Sr2TlZn",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-104874",
"created_at": "2022-09-04T14:36:55.034316Z",
"updated_at": "2022-09-04T14:36:55.034342Z",
"structure_string": "Sr2 Tl1 Pb1\n1.0\n5.000422 -0.000000 2.886995\n1.666807 4.714443 2.886995\n-0.000000 -0.000000 5.773990\nSr Tl Pb\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Sr\n0.750000 0.749999 0.750001 Sr\n0.000000 0.000000 0.000000 Tl\n0.500000 0.500000 0.500001 Pb\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sr",
"Tl",
"Pb"
],
"chemical_system": "Pb-Sr-Tl",
"density": 7.15885181608908,
"density_atomic": 0.029386435972374322,
"volume": 136.11722101177327,
"volume_molar": 20.49292661982321,
"formula_full": "Sr2 Tl1 Pb1",
"formula_reduced": "Sr2TlPb",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-110469",
"created_at": "2022-09-04T14:38:38.449843Z",
"updated_at": "2022-09-04T14:38:38.449873Z",
"structure_string": "Sr2 Tl1 In1\n1.0\n4.963875 0.000000 2.865894\n1.654625 4.679986 2.865894\n-0.000000 0.000000 5.731788\nSr Tl In\n2 1 1\ndirect\n0.249999 0.250000 0.250000 Sr\n0.749998 0.750001 0.750000 Sr\n0.000000 0.000000 0.000000 Tl\n0.499999 0.500000 0.500000 In\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sr",
"Tl",
"In"
],
"chemical_system": "In-Sr-Tl",
"density": 6.166068253241614,
"density_atomic": 0.030040314973381613,
"volume": 133.15439613547179,
"volume_molar": 20.04686290851528,
"formula_full": "Sr2 Tl1 In1",
"formula_reduced": "Sr2TlIn",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-81962",
"created_at": "2022-09-04T14:37:16.702916Z",
"updated_at": "2022-09-04T14:37:16.702946Z",
"structure_string": "Sr2 Tl1 In1\n1.0\n-11.447123 0.000000 -6.609000\n-12.083384 0.023044 7.711037\n-7.854366 11.984515 0.386162\nSr Tl In\n2 1 1\ndirect\n0.751104 -0.000000 0.000000 Sr\n0.248896 -0.000000 0.000000 Sr\n0.500000 -0.000000 0.000000 Tl\n0.000000 0.000000 0.000000 In\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sr",
"Tl",
"In"
],
"chemical_system": "In-Sr-Tl",
"density": 0.40773922406982793,
"density_atomic": 0.0019864546117569384,
"volume": 2013.6377525697214,
"volume_molar": 303.1602496406229,
"formula_full": "Sr2 Tl1 In1",
"formula_reduced": "Sr2TlIn",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.4601425,
"spacegroup": 71
},
{
"id": "jvasp-109594",
"created_at": "2022-09-04T14:38:20.031537Z",
"updated_at": "2022-09-04T14:38:20.031553Z",
"structure_string": "Sr2 Tl1 Hg1\n1.0\n4.915247 -0.000000 2.837819\n1.638416 4.634139 2.837819\n-0.000000 -0.000000 5.675638\nSr Tl Hg\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Sr\n0.750001 0.750000 0.750000 Sr\n0.000000 0.000000 0.000000 Tl\n0.500001 0.500000 0.500000 Hg\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sr",
"Tl",
"Hg"
],
"chemical_system": "Hg-Sr-Tl",
"density": 7.452597842219318,
"density_atomic": 0.03094075454597596,
"volume": 129.27932943769224,
"volume_molar": 19.46345798080486,
"formula_full": "Sr2 Tl1 Hg1",
"formula_reduced": "Sr2TlHg",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-54558",
"created_at": "2022-09-04T14:38:36.255731Z",
"updated_at": "2022-09-04T14:38:36.255757Z",
"structure_string": "Sr2 Tl1 Cu1 O5\n1.0\n3.726375 0.000000 0.000000\n0.000000 3.726621 0.000000\n0.000000 0.000000 9.035440\nSr Tl Cu O\n2 1 1 5\ndirect\n0.500001 0.500000 0.287610 Sr\n0.500001 0.500000 0.712390 Sr\n0.000000 0.000000 0.000000 Tl\n0.000000 0.000000 0.500000 Cu\n0.000000 0.500000 0.500000 O\n0.500001 0.000000 0.500000 O\n0.000000 0.000000 0.767284 O\n0.000000 0.000000 0.232716 O\n0.500001 0.500000 0.000000 O\n",
"nsites": 9,
"nelements": 4,
"elements": [
"Sr",
"Tl",
"Cu",
"O"
],
"chemical_system": "Cu-O-Sr-Tl",
"density": 6.923692438948576,
"density_atomic": 0.0717284454572754,
"volume": 125.47323370281032,
"volume_molar": 8.395749721896665,
"formula_full": "Sr2 Tl1 Cu1 O5",
"formula_reduced": "Sr2TlCuO5",
"formula_anonymous": "ABC2D5",
"energy_above_hull": 1.0938614633333332,
"spacegroup": 123
},
{
"id": "jvasp-42014",
"created_at": "2022-09-04T14:37:31.934844Z",
"updated_at": "2022-09-04T14:37:31.934864Z",
"structure_string": "Sr2 Tl1 Cd1\n1.0\n0.000000 4.033015 4.033015\n4.033015 0.000000 4.033015\n4.033015 4.033015 -0.000000\nSr Tl Cd\n2 1 1\ndirect\n0.500001 0.500001 0.500001 Sr\n0.000000 0.000000 0.000000 Sr\n0.750001 0.750001 0.750001 Tl\n0.250001 0.250001 0.250001 Cd\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sr",
"Tl",
"Cd"
],
"chemical_system": "Cd-Sr-Tl",
"density": 6.2276610686687,
"density_atomic": 0.030488810697998473,
"volume": 131.19567173745455,
"volume_molar": 19.751970057642627,
"formula_full": "Sr2 Tl1 Cd1",
"formula_reduced": "Sr2TlCd",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-105402",
"created_at": "2022-09-04T14:37:02.911053Z",
"updated_at": "2022-09-04T14:37:02.911072Z",
"structure_string": "Sr2 Ti1 Ru1 O6\n1.0\n3.920380 -0.000000 0.000000\n0.000000 3.920380 0.000000\n-0.000000 -0.000000 7.917470\nSr Ti Ru O\n2 1 1 6\ndirect\n0.500000 0.500000 0.745704 Sr\n0.500000 0.500000 0.254296 Sr\n0.000000 0.000000 0.500000 Ti\n0.000000 0.000000 0.000000 Ru\n0.000000 0.000000 0.745954 O\n0.000000 0.000000 0.254046 O\n0.500000 0.000000 0.500000 O\n0.500000 0.000000 -0.000000 O\n-0.000000 0.500000 0.500000 O\n-0.000000 0.500000 -0.000000 O\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Sr",
"Ti",
"Ru",
"O"
],
"chemical_system": "O-Ru-Sr-Ti",
"density": 5.733699077352763,
"density_atomic": 0.08217831716913303,
"volume": 121.68659987790669,
"volume_molar": 7.32813833070553,
"formula_full": "Sr2 Ti1 Ru1 O6",
"formula_reduced": "Sr2TiRuO6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 2.3204022453333337,
"spacegroup": 123
},
{
"id": "jvasp-86515",
"created_at": "2022-09-04T14:35:48.459538Z",
"updated_at": "2022-09-04T14:35:48.459556Z",
"structure_string": "Sr2 Ti1 O4\n1.0\n3.749093 0.000000 -1.104393\n-0.325328 3.734951 -1.104393\n-0.003652 -0.003984 6.903337\nSr Ti O\n2 1 4\ndirect\n0.645343 0.645344 0.290687 Sr\n0.354656 0.354657 0.709314 Sr\n0.000000 0.000000 0.000000 Ti\n0.841439 0.841440 0.682879 O\n0.158561 0.158561 0.317122 O\n-0.000000 0.500000 0.000000 O\n0.500000 -0.000000 0.000000 O\n",
"nsites": 7,
"nelements": 3,
"elements": [
"Sr",
"Ti",
"O"
],
"chemical_system": "O-Sr-Ti",
"density": 4.933638194358969,
"density_atomic": 0.07243960763055213,
"volume": 96.63221860201904,
"volume_molar": 8.31332603389213,
"formula_full": "Sr2 Ti1 O4",
"formula_reduced": "Sr2TiO4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 1.5356564219047617,
"spacegroup": 139
},
{
"id": "jvasp-113733",
"created_at": "2022-09-04T14:38:49.005134Z",
"updated_at": "2022-09-04T14:38:49.005162Z",
"structure_string": "Sr2 Ti1 O3\n1.0\n-1.749532 1.749532 7.304449\n1.749532 -1.749532 7.304449\n1.749532 1.749532 -7.304449\nSr Ti O\n2 1 3\ndirect\n0.660929 0.660929 0.000000 Sr\n0.339072 0.339072 0.000000 Sr\n0.000000 0.000000 0.000000 Ti\n0.500000 0.500000 0.000000 O\n0.149274 0.149274 0.000000 O\n0.850727 0.850727 0.000000 O\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Sr",
"Ti",
"O"
],
"chemical_system": "O-Sr-Ti",
"density": 5.033797166122315,
"density_atomic": 0.0670903437532448,
"volume": 89.43164789955055,
"volume_molar": 8.976166200830862,
"formula_full": "Sr2 Ti1 O3",
"formula_reduced": "Sr2TiO3",
"formula_anonymous": "AB2C3",
"energy_above_hull": 1.4011885755555555,
"spacegroup": 139
}
]
}