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=3547",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=formula_reduced&page=3545",
"results": [
{
"id": "jvasp-122906",
"created_at": "2022-09-04T14:38:55.307428Z",
"updated_at": "2022-09-04T14:38:55.307446Z",
"structure_string": "Sm3 W1\n1.0\n1.752033 -3.034610 0.000000\n1.752033 3.034610 -0.000000\n0.000000 0.000000 10.500210\nSm W\n3 1\ndirect\n0.000000 0.000000 0.500000 Sm\n0.333332 0.666666 0.208220 Sm\n0.666666 0.333332 0.791780 Sm\n0.000000 0.000000 0.000000 W\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Sm",
"W"
],
"chemical_system": "Sm-W",
"density": 9.442673165328504,
"density_atomic": 0.035825053217371866,
"volume": 111.65370713421207,
"volume_molar": 16.809858518451033,
"formula_full": "Sm3 W1",
"formula_reduced": "Sm3W",
"formula_anonymous": "AB3",
"energy_above_hull": null,
"spacegroup": 164
},
{
"id": "jvasp-122909",
"created_at": "2022-09-04T14:38:55.272401Z",
"updated_at": "2022-09-04T14:38:55.272426Z",
"structure_string": "Sm3 Y1\n1.0\n1.798333 -3.114804 -0.000000\n1.798333 3.114804 0.000000\n0.000000 0.000000 11.591277\nSm Y\n3 1\ndirect\n0.000000 0.000000 0.500000 Sm\n0.333332 0.666666 0.249087 Sm\n0.666666 0.333332 0.750913 Sm\n0.000000 0.000000 0.000000 Y\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Sm",
"Y"
],
"chemical_system": "Sm-Y",
"density": 6.905090253003197,
"density_atomic": 0.03080334455316531,
"volume": 129.85602888336246,
"volume_molar": 19.55028211175586,
"formula_full": "Sm3 Y1",
"formula_reduced": "Sm3Y",
"formula_anonymous": "AB3",
"energy_above_hull": null,
"spacegroup": 164
},
{
"id": "jvasp-37392",
"created_at": "2022-09-04T14:37:55.862533Z",
"updated_at": "2022-09-04T14:37:55.862553Z",
"structure_string": "Sm6 Y2\n1.0\n3.617493 -6.265682 0.000000\n3.617493 6.265682 -0.000000\n0.000000 0.000000 5.760362\nSm Y\n6 2\ndirect\n0.833447 0.666894 0.750000 Sm\n0.833447 0.166552 0.750000 Sm\n0.333105 0.166552 0.750000 Sm\n0.166552 0.333105 0.250000 Sm\n0.166552 0.833447 0.250000 Sm\n0.666894 0.833447 0.250000 Sm\n0.666666 0.333333 0.250000 Y\n0.333333 0.666666 0.750000 Y\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Sm",
"Y"
],
"chemical_system": "Sm-Y",
"density": 6.867610426789723,
"density_atomic": 0.030636148476308207,
"volume": 261.1294303586048,
"volume_molar": 19.656977327476692,
"formula_full": "Sm6 Y2",
"formula_reduced": "Sm3Y",
"formula_anonymous": "AB3",
"energy_above_hull": 1.87595551875,
"spacegroup": 194
},
{
"id": "jvasp-106335",
"created_at": "2022-09-04T14:37:48.710436Z",
"updated_at": "2022-09-04T14:37:48.710449Z",
"structure_string": "Sm3 Y1 S4\n1.0\n6.787150 -0.039387 1.204020\n5.646986 3.765435 1.204020\n-0.043315 -0.012980 6.901037\nSm Y S\n3 1 4\ndirect\n0.247228 0.247228 0.253468 Sm\n0.500000 0.500000 0.500000 Sm\n0.752773 0.752772 0.746532 Sm\n0.000000 0.000000 0.000000 Y\n0.621962 0.621962 0.119421 S\n0.876555 0.876555 0.367732 S\n0.123446 0.123445 0.632268 S\n0.378039 0.378039 0.880579 S\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Sm",
"Y",
"S"
],
"chemical_system": "S-Sm-Y",
"density": 6.229849116836622,
"density_atomic": 0.04491404270822411,
"volume": 178.118012042927,
"volume_molar": 13.40814675517352,
"formula_full": "Sm3 Y1 S4",
"formula_reduced": "Sm3YS4",
"formula_anonymous": "AB3C4",
"energy_above_hull": 1.922960259375,
"spacegroup": 12
},
{
"id": "jvasp-37296",
"created_at": "2022-09-04T14:37:55.608896Z",
"updated_at": "2022-09-04T14:37:55.608906Z",
"structure_string": "Sm3 Zn1\n1.0\n-2.350231 2.350231 4.903788\n2.350231 -2.350231 4.903788\n2.350231 2.350231 -4.903788\nSm Zn\n3 1\ndirect\n0.750000 0.250000 0.500000 Sm\n0.250000 0.750000 0.500000 Sm\n0.500000 0.500000 0.000000 Sm\n0.000000 0.000000 0.000000 Zn\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Sm",
"Zn"
],
"chemical_system": "Sm-Zn",
"density": 7.915847070450722,
"density_atomic": 0.03691876908074459,
"volume": 108.3459741372105,
"volume_molar": 16.31186767584003,
"formula_full": "Sm3 Zn1",
"formula_reduced": "Sm3Zn",
"formula_anonymous": "AB3",
"energy_above_hull": 1.1028477124999998,
"spacegroup": 139
},
{
"id": "jvasp-122912",
"created_at": "2022-09-04T14:38:55.193774Z",
"updated_at": "2022-09-04T14:38:55.193805Z",
"structure_string": "Sm3 Zn1\n1.0\n1.812318 -3.139027 -0.000000\n1.812318 3.139027 0.000000\n-0.000000 -0.000000 10.370143\nSm Zn\n3 1\ndirect\n0.000000 0.000000 0.500000 Sm\n0.333333 0.666668 0.216188 Sm\n0.666668 0.333333 0.783812 Sm\n0.000000 0.000000 0.000000 Zn\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Sm",
"Zn"
],
"chemical_system": "Sm-Zn",
"density": 7.268854538014996,
"density_atomic": 0.033901256527839665,
"volume": 117.98972692104215,
"volume_molar": 17.763768593811932,
"formula_full": "Sm3 Zn1",
"formula_reduced": "Sm3Zn",
"formula_anonymous": "AB3",
"energy_above_hull": null,
"spacegroup": 164
},
{
"id": "jvasp-122913",
"created_at": "2022-09-04T14:38:54.955325Z",
"updated_at": "2022-09-04T14:38:54.955353Z",
"structure_string": "Sm3 Zr1\n1.0\n1.746133 -3.024392 0.000000\n1.746133 3.024392 -0.000000\n0.000000 0.000000 11.306243\nSm Zr\n3 1\ndirect\n0.000000 0.000000 0.500000 Sm\n0.333332 0.666666 0.234713 Sm\n0.666666 0.333332 0.765286 Sm\n0.000000 0.000000 0.000000 Zr\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Sm",
"Zr"
],
"chemical_system": "Sm-Zr",
"density": 7.540987024886443,
"density_atomic": 0.033496256969444076,
"volume": 119.41632773025583,
"volume_molar": 17.9785483658473,
"formula_full": "Sm3 Zr1",
"formula_reduced": "Sm3Zr",
"formula_anonymous": "AB3",
"energy_above_hull": null,
"spacegroup": 164
},
{
"id": "jvasp-39023",
"created_at": "2022-09-04T14:37:55.288913Z",
"updated_at": "2022-09-04T14:37:55.288937Z",
"structure_string": "Sm3 Zr1\n1.0\n-2.458984 2.458984 4.879674\n2.458984 -2.458984 4.879674\n2.458984 2.458984 -4.879674\nSm Zr\n3 1\ndirect\n0.749999 0.250000 0.499999 Sm\n0.250000 0.749999 0.499999 Sm\n0.500000 0.500000 0.000000 Sm\n0.000000 0.000000 0.000000 Zr\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Sm",
"Zr"
],
"chemical_system": "Sm-Zr",
"density": 7.630090680051628,
"density_atomic": 0.03389204586557664,
"volume": 118.02179236582194,
"volume_molar": 17.768596159361827,
"formula_full": "Sm3 Zr1",
"formula_reduced": "Sm3Zr",
"formula_anonymous": "AB3",
"energy_above_hull": 2.24925778125,
"spacegroup": 139
},
{
"id": "jvasp-94867",
"created_at": "2022-09-04T14:36:18.223911Z",
"updated_at": "2022-09-04T14:36:18.223935Z",
"structure_string": "Sm4 Bi2 O1\n1.0\n4.682858 -0.000000 -0.000000\n-0.000000 4.682858 -0.000000\n-2.341429 -2.341429 8.583702\nSm Bi O\n4 2 1\ndirect\n0.500000 0.000000 0.000000 Sm\n0.000000 0.500000 0.000000 Sm\n0.827974 0.827974 0.655949 Sm\n0.172025 0.172025 0.344051 Sm\n0.641161 0.641161 0.282323 Bi\n0.358839 0.358839 0.717677 Bi\n0.000000 0.000000 0.000000 O\n",
"nsites": 7,
"nelements": 3,
"elements": [
"Sm",
"Bi",
"O"
],
"chemical_system": "Bi-O-Sm",
"density": 9.133994226050968,
"density_atomic": 0.03718788084503036,
"volume": 188.23336638004346,
"volume_molar": 16.193826115275336,
"formula_full": "Sm4 Bi2 O1",
"formula_reduced": "Sm4Bi2O",
"formula_anonymous": "AB2C4",
"energy_above_hull": 1.4870368,
"spacegroup": 139
},
{
"id": "jvasp-23896",
"created_at": "2022-09-04T14:37:44.371108Z",
"updated_at": "2022-09-04T14:37:44.371138Z",
"structure_string": "Sm8 Bi6\n1.0\n7.792700 -0.000000 -2.755136\n-3.896350 6.748676 -2.755136\n0.000000 0.000000 8.265407\nSm Bi\n8 6\ndirect\n0.144750 0.144750 0.144750 Sm\n0.855250 0.500000 -0.000001 Sm\n0.000000 0.855251 0.500000 Sm\n0.500000 0.000000 0.855250 Sm\n0.000000 0.355250 0.500000 Sm\n0.500000 0.000000 0.355250 Sm\n0.355250 0.500000 -0.000000 Sm\n0.644750 0.644750 0.644750 Sm\n0.250000 0.625000 0.375000 Bi\n0.375000 0.250000 0.625000 Bi\n0.125000 0.750000 0.875000 Bi\n0.875000 0.125000 0.750000 Bi\n0.625000 0.375000 0.250000 Bi\n0.750000 0.875001 0.124999 Bi\n",
"nsites": 14,
"nelements": 2,
"elements": [
"Sm",
"Bi"
],
"chemical_system": "Bi-Sm",
"density": 9.385155545342911,
"density_atomic": 0.03220751785981165,
"volume": 434.6811219957163,
"volume_molar": 18.69793501694954,
"formula_full": "Sm8 Bi6",
"formula_reduced": "Sm4Bi3",
"formula_anonymous": "A3B4",
"energy_above_hull": 1.3183169142857143,
"spacegroup": 220
},
{
"id": "jvasp-34394",
"created_at": "2022-09-04T14:38:32.810455Z",
"updated_at": "2022-09-04T14:38:32.810488Z",
"structure_string": "Sm8 Br12 O2\n1.0\n4.698096 -8.137341 0.000000\n4.698096 8.137341 -0.000000\n0.000000 -0.000000 7.642166\nSm Br O\n8 12 2\ndirect\n0.195927 0.391855 -0.002561 Sm\n0.195928 0.804073 -0.002561 Sm\n0.804073 0.195928 0.497439 Sm\n0.666667 0.333333 0.828379 Sm\n0.804073 0.608145 0.497439 Sm\n0.391855 0.195927 0.497439 Sm\n0.333333 0.666667 0.328378 Sm\n0.608145 0.804073 -0.002561 Sm\n0.521898 0.043795 0.192293 Br\n0.478102 0.521898 0.692293 Br\n0.865310 0.730619 0.877709 Br\n0.730619 0.865310 0.377709 Br\n0.478103 0.956205 0.692293 Br\n0.865309 0.134691 0.877709 Br\n0.134691 0.269382 0.377709 Br\n0.134691 0.865309 0.377709 Br\n0.521898 0.478102 0.192293 Br\n0.043795 0.521898 0.692293 Br\n0.269382 0.134691 0.877709 Br\n0.956205 0.478103 0.192293 Br\n0.666667 0.333333 0.514490 O\n0.333333 0.666667 0.014490 O\n",
"nsites": 22,
"nelements": 3,
"elements": [
"Sm",
"Br",
"O"
],
"chemical_system": "Br-O-Sm",
"density": 6.234200607380441,
"density_atomic": 0.0376505925499623,
"volume": 584.3201530176722,
"volume_molar": 15.994810047168913,
"formula_full": "Sm8 Br12 O2",
"formula_reduced": "Sm4Br6O",
"formula_anonymous": "AB4C6",
"energy_above_hull": 0.7165348754545455,
"spacegroup": 186
},
{
"id": "jvasp-5539",
"created_at": "2022-09-04T14:36:45.808732Z",
"updated_at": "2022-09-04T14:36:45.808750Z",
"structure_string": "Sm8 Cl12 O2\n1.0\n4.594551 -7.957997 0.000000\n4.594551 7.957997 0.000000\n0.000000 0.000000 6.990743\nSm Cl O\n8 12 2\ndirect\n0.807135 0.192865 0.515333 Sm\n0.614269 0.807134 0.015334 Sm\n0.192865 0.385731 0.015334 Sm\n0.807134 0.614269 0.515333 Sm\n0.385731 0.192865 0.515333 Sm\n0.192865 0.807135 0.015334 Sm\n0.666667 0.333333 0.866013 Sm\n0.333333 0.666667 0.366014 Sm\n0.135726 0.271453 0.414979 Cl\n0.864274 0.728546 0.914978 Cl\n0.271453 0.135726 0.914978 Cl\n0.135726 0.864274 0.414979 Cl\n0.022431 0.511215 0.725823 Cl\n0.511215 0.488784 0.225823 Cl\n0.977569 0.488784 0.225823 Cl\n0.864274 0.135726 0.914978 Cl\n0.488784 0.511215 0.725823 Cl\n0.511215 0.022431 0.225823 Cl\n0.488784 0.977569 0.725823 Cl\n0.728546 0.864274 0.414979 Cl\n0.333333 0.666667 0.021879 O\n0.666667 0.333333 0.521878 O\n",
"nsites": 22,
"nelements": 3,
"elements": [
"Sm",
"Cl",
"O"
],
"chemical_system": "Cl-O-Sm",
"density": 5.393110973569774,
"density_atomic": 0.04303506873660067,
"volume": 511.2109878260595,
"volume_molar": 13.993566030668987,
"formula_full": "Sm8 Cl12 O2",
"formula_reduced": "Sm4Cl6O",
"formula_anonymous": "AB4C6",
"energy_above_hull": 0.8112939459090911,
"spacegroup": 186
}
]
}