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=1262",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=energy_above_hull&page=1260",
"results": [
{
"id": "jvasp-78987",
"created_at": "2022-09-04T14:36:41.062480Z",
"updated_at": "2022-09-04T14:36:41.062501Z",
"structure_string": "Zn1 Ni3\n1.0\n3.574415 -0.000000 0.000000\n0.000000 3.574415 -0.000000\n0.000000 -0.000000 3.574415\nZn Ni\n1 3\ndirect\n0.000000 0.000000 0.000000 Zn\n0.000000 0.500001 0.500001 Ni\n0.500001 0.000000 0.500001 Ni\n0.500001 0.500001 0.000000 Ni\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Zn",
"Ni"
],
"chemical_system": "Ni-Zn",
"density": 8.780755580828092,
"density_atomic": 0.08758809272659177,
"volume": 45.668308048287926,
"volume_molar": 6.875524483445769,
"formula_full": "Zn1 Ni3",
"formula_reduced": "ZnNi3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.6744791000000001,
"spacegroup": 221
},
{
"id": "jvasp-90607",
"created_at": "2022-09-04T14:36:20.247798Z",
"updated_at": "2022-09-04T14:36:20.247825Z",
"structure_string": "Dy2 Ag2 Se4\n1.0\n5.663740 -0.000000 -0.000000\n-0.000000 5.663740 -0.000000\n-2.831869 -2.831869 6.151710\nDy Ag Se\n2 2 4\ndirect\n0.252116 0.752116 0.504233 Dy\n0.002116 0.002116 0.004233 Dy\n0.786753 0.286753 0.573505 Ag\n0.536753 0.536753 0.073505 Ag\n0.483677 0.983677 0.967355 Se\n0.233677 0.233677 0.467355 Se\n0.017454 0.517454 0.034907 Se\n0.767454 0.767454 0.534908 Se\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Dy",
"Ag",
"Se"
],
"chemical_system": "Ag-Dy-Se",
"density": 7.207966032847661,
"density_atomic": 0.040540352088250915,
"volume": 197.33425063958674,
"volume_molar": 14.854682926508891,
"formula_full": "Dy2 Ag2 Se4",
"formula_reduced": "DyAgSe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.6745001233333332,
"spacegroup": 109
},
{
"id": "jvasp-100819",
"created_at": "2022-09-04T14:36:38.699728Z",
"updated_at": "2022-09-04T14:36:38.699745Z",
"structure_string": "Mn1 Hg2 Te3\n1.0\n4.624355 0.000000 0.000000\n-2.312178 4.004808 0.000000\n-0.000000 -0.000000 11.165564\nMn Hg Te\n1 2 3\ndirect\n0.333333 0.666667 0.661173 Mn\n0.000000 0.000000 0.995804 Hg\n0.666666 0.333333 0.340781 Hg\n0.000000 0.000000 0.250664 Te\n0.666666 0.333333 0.598186 Te\n0.333333 0.666667 0.903390 Te\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Mn",
"Hg",
"Te"
],
"chemical_system": "Hg-Mn-Te",
"density": 6.736822458318274,
"density_atomic": 0.029016011784423146,
"volume": 206.78238086534756,
"volume_molar": 20.75454340431756,
"formula_full": "Mn1 Hg2 Te3",
"formula_reduced": "MnHg2Te3",
"formula_anonymous": "AB2C3",
"energy_above_hull": 0.6746566235632183,
"spacegroup": 156
},
{
"id": "jvasp-52101",
"created_at": "2022-09-04T14:38:29.092978Z",
"updated_at": "2022-09-04T14:38:29.092989Z",
"structure_string": "Er8 Sn4 Au8\n1.0\n7.868595 0.000000 0.000000\n0.000000 7.868595 0.000000\n0.000000 0.000000 7.392906\nEr Sn Au\n8 4 8\ndirect\n0.341908 0.658092 0.000000 Er\n0.158092 0.158092 0.500000 Er\n0.841909 0.841909 0.500000 Er\n0.658092 0.341908 0.000000 Er\n0.180460 0.180460 0.000000 Er\n0.680461 0.319540 0.500000 Er\n0.319540 0.680461 0.500000 Er\n0.819540 0.819540 0.000000 Er\n0.500000 0.000000 0.250000 Sn\n0.500000 0.000000 0.750000 Sn\n0.000000 0.500000 0.250000 Sn\n0.000000 0.500000 0.750000 Sn\n0.628527 0.628527 0.726944 Au\n0.371474 0.371474 0.726944 Au\n0.871474 0.128526 0.226944 Au\n0.128526 0.871474 0.226944 Au\n0.628527 0.628527 0.273056 Au\n0.128526 0.871474 0.773057 Au\n0.871474 0.128526 0.773057 Au\n0.371474 0.371474 0.273056 Au\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Er",
"Sn",
"Au"
],
"chemical_system": "Au-Er-Sn",
"density": 12.29321690553217,
"density_atomic": 0.0436938613583512,
"volume": 457.7302023268631,
"volume_molar": 13.782578542578245,
"formula_full": "Er8 Sn4 Au8",
"formula_reduced": "Er2SnAu2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 0.6746893679999999,
"spacegroup": 136
},
{
"id": "jvasp-62407",
"created_at": "2022-09-04T14:35:46.243958Z",
"updated_at": "2022-09-04T14:35:46.243994Z",
"structure_string": "Er8 Sn4 Au8\n1.0\n7.868913 0.000000 0.000000\n0.000000 7.868913 0.000000\n0.000000 0.000000 7.391776\nEr Sn Au\n8 4 8\ndirect\n0.341955 0.341955 0.000000 Er\n0.658045 0.658045 0.000000 Er\n0.841955 0.158045 0.500000 Er\n0.158045 0.841955 0.500000 Er\n0.819498 0.180501 0.000000 Er\n0.180501 0.819498 0.000000 Er\n0.680501 0.680501 0.500000 Er\n0.319499 0.319499 0.500000 Er\n0.000000 0.500000 0.750000 Sn\n0.000000 0.500000 0.250000 Sn\n0.500000 0.000000 0.750000 Sn\n0.500000 0.000000 0.250000 Sn\n0.128529 0.128529 0.226848 Au\n0.871471 0.871471 0.226848 Au\n0.628529 0.371471 0.726848 Au\n0.371471 0.628529 0.726848 Au\n0.628529 0.371471 0.273152 Au\n0.371471 0.628529 0.273152 Au\n0.128529 0.128529 0.773153 Au\n0.871471 0.871471 0.773153 Au\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Er",
"Sn",
"Au"
],
"chemical_system": "Au-Er-Sn",
"density": 12.294102478111512,
"density_atomic": 0.04369700895476976,
"volume": 457.6972309638345,
"volume_molar": 13.78158575163221,
"formula_full": "Er8 Sn4 Au8",
"formula_reduced": "Er2SnAu2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 0.674703368,
"spacegroup": 136
},
{
"id": "jvasp-44740",
"created_at": "2022-09-04T14:38:10.525073Z",
"updated_at": "2022-09-04T14:38:10.525088Z",
"structure_string": "Li3 Fe1 O1 F4\n1.0\n3.699352 0.000376 0.000232\n-1.849117 -4.831234 0.016401\n-1.849461 0.238085 -4.941144\nLi Fe O F\n3 1 1 4\ndirect\n0.574101 0.770566 0.441612 Li\n0.396756 0.243295 0.614189 Li\n0.756941 0.429226 0.148634 Li\n0.963525 0.997026 0.994019 Fe\n0.480723 0.028191 0.997231 O\n0.034224 0.790923 0.341512 F\n0.276398 0.372403 0.244364 F\n0.672160 0.608410 0.799885 F\n0.850031 0.144740 0.619301 F\n",
"nsites": 9,
"nelements": 4,
"elements": [
"Li",
"Fe",
"O",
"F"
],
"chemical_system": "F-Fe-Li-O",
"density": 3.172132058221911,
"density_atomic": 0.1019365584734009,
"volume": 88.29020848637381,
"volume_molar": 5.907734035940996,
"formula_full": "Li3 Fe1 O1 F4",
"formula_reduced": "Li3FeOF4",
"formula_anonymous": "ABC3D4",
"energy_above_hull": 0.67477557,
"spacegroup": 8
},
{
"id": "jvasp-114022",
"created_at": "2022-09-04T14:38:49.938606Z",
"updated_at": "2022-09-04T14:38:49.938635Z",
"structure_string": "S1 F1\n1.0\n3.866745 -0.000000 0.000000\n-1.933373 3.348700 -0.000000\n0.000000 -0.000000 2.375844\nS F\n1 1\ndirect\n0.000000 0.000000 0.000000 S\n0.333336 0.666668 0.000000 F\n",
"nsites": 2,
"nelements": 2,
"elements": [
"S",
"F"
],
"chemical_system": "F-S",
"density": 2.7562534935108514,
"density_atomic": 0.06501151695232173,
"volume": 30.763779923282883,
"volume_molar": 9.263190650383576,
"formula_full": "S1 F1",
"formula_reduced": "SF",
"formula_anonymous": "AB",
"energy_above_hull": 0.6749374999999999,
"spacegroup": 187
},
{
"id": "jvasp-91695",
"created_at": "2022-09-04T14:35:51.725552Z",
"updated_at": "2022-09-04T14:35:51.725584Z",
"structure_string": "Tb4 Pt4\n1.0\n0.000000 4.510922 -0.000000\n0.000000 -0.000000 5.585127\n7.068257 0.000000 0.000000\nTb Pt\n4 4\ndirect\n0.250000 0.357361 0.682645 Tb\n0.250000 0.142639 0.182645 Tb\n0.750000 0.642639 0.317355 Tb\n0.750000 0.857362 0.817355 Tb\n0.250000 0.841163 0.545088 Pt\n0.250000 0.658838 0.045087 Pt\n0.750000 0.158837 0.454913 Pt\n0.750000 0.341163 0.954913 Pt\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Tb",
"Pt"
],
"chemical_system": "Pt-Tb",
"density": 13.204231165731315,
"density_atomic": 0.0449240895671781,
"volume": 178.07817758971046,
"volume_molar": 13.405148146618924,
"formula_full": "Tb4 Pt4",
"formula_reduced": "TbPt",
"formula_anonymous": "AB",
"energy_above_hull": 0.6749649,
"spacegroup": 62
},
{
"id": "jvasp-67607",
"created_at": "2022-09-04T14:36:03.555252Z",
"updated_at": "2022-09-04T14:36:03.555270Z",
"structure_string": "Na1 Be1 Ge1\n1.0\n-1.658285 1.658285 5.210245\n1.658285 -1.658285 5.210245\n1.658285 1.658285 -5.210245\nNa Be Ge\n1 1 1\ndirect\n0.669469 0.669469 0.000000 Na\n0.945660 0.945660 0.000000 Be\n0.384870 0.384870 0.000000 Ge\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Na",
"Be",
"Ge"
],
"chemical_system": "Be-Ge-Na",
"density": 3.0319249394230585,
"density_atomic": 0.05234615335988965,
"volume": 57.3108014140874,
"volume_molar": 11.504457106134712,
"formula_full": "Na1 Be1 Ge1",
"formula_reduced": "NaBeGe",
"formula_anonymous": "ABC",
"energy_above_hull": 0.6753036833333332,
"spacegroup": 107
},
{
"id": "jvasp-118891",
"created_at": "2022-09-04T14:38:50.711368Z",
"updated_at": "2022-09-04T14:38:50.711383Z",
"structure_string": "Li2 F1\n1.0\n2.705373 0.000000 0.000000\n0.000000 2.981696 0.000000\n0.000000 0.000000 5.087237\nLi F\n2 1\ndirect\n-0.033326 0.000000 0.756234 Li\n-0.033326 0.000000 0.243767 Li\n0.466652 0.000000 0.000000 F\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Li",
"F"
],
"chemical_system": "F-Li",
"density": 1.330496532977374,
"density_atomic": 0.0731052842294585,
"volume": 41.036705234381955,
"volume_molar": 8.237627174935897,
"formula_full": "Li2 F1",
"formula_reduced": "Li2F",
"formula_anonymous": "AB2",
"energy_above_hull": 0.6753166666666668,
"spacegroup": 47
},
{
"id": "jvasp-21747",
"created_at": "2022-09-04T14:37:38.303528Z",
"updated_at": "2022-09-04T14:37:38.303557Z",
"structure_string": "Pr4 Cd2 Ni4\n1.0\n7.561040 0.000000 0.000000\n-0.000000 7.561040 0.000000\n-0.000000 0.000000 3.845630\nPr Cd Ni\n4 2 4\ndirect\n0.322169 0.822169 0.500000 Pr\n0.822169 0.677831 0.500000 Pr\n0.177831 0.322169 0.500000 Pr\n0.677831 0.177831 0.500000 Pr\n0.000000 0.000000 0.000000 Cd\n0.500000 0.500000 0.000000 Cd\n0.383571 0.116429 0.000000 Ni\n0.883571 0.383571 0.000000 Ni\n0.116429 0.616429 0.000000 Ni\n0.616429 0.883571 0.000000 Ni\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Pr",
"Cd",
"Ni"
],
"chemical_system": "Cd-Ni-Pr",
"density": 7.7284104844770205,
"density_atomic": 0.045485129099180795,
"volume": 219.8520746900574,
"volume_molar": 13.23980140161559,
"formula_full": "Pr4 Cd2 Ni4",
"formula_reduced": "Pr2CdNi2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 0.6753488500000003,
"spacegroup": 127
},
{
"id": "jvasp-59088",
"created_at": "2022-09-04T14:38:36.927894Z",
"updated_at": "2022-09-04T14:38:36.927915Z",
"structure_string": "Rb6 Os4 Br18\n1.0\n3.702485 -6.412892 -0.000000\n3.702485 6.412892 0.000000\n-0.000000 -0.000000 17.878576\nRb Os Br\n6 4 18\ndirect\n0.333332 0.666666 0.430482 Rb\n0.666666 0.333332 0.930483 Rb\n0.666666 0.333332 0.569518 Rb\n0.333332 0.666666 0.069518 Rb\n0.000000 0.000000 0.750000 Rb\n0.000000 0.000000 0.250000 Rb\n0.666666 0.333332 0.325879 Os\n0.333332 0.666666 0.825880 Os\n0.666666 0.333332 0.174121 Os\n0.333332 0.666666 0.674121 Os\n0.652997 0.826497 0.592142 Br\n0.173501 0.826498 0.592142 Br\n0.826497 0.652997 0.407859 Br\n0.347002 0.173501 0.407859 Br\n0.652997 0.826497 0.907859 Br\n0.173501 0.347002 0.907859 Br\n0.826498 0.173501 0.407859 Br\n0.347002 0.173501 0.092141 Br\n-0.006462 0.496769 0.750000 Br\n0.826497 0.652997 0.092141 Br\n0.496769 0.503230 0.250000 Br\n0.503230 0.006462 0.750000 Br\n0.173501 0.347002 0.592142 Br\n0.006462 0.503230 0.250000 Br\n0.496769 -0.006462 0.250000 Br\n0.503230 0.496769 0.750000 Br\n0.826498 0.173501 0.092141 Br\n0.173501 0.826498 0.907859 Br\n",
"nsites": 28,
"nelements": 3,
"elements": [
"Rb",
"Os",
"Br"
],
"chemical_system": "Br-Os-Rb",
"density": 5.304304363514602,
"density_atomic": 0.032979789320561996,
"volume": 849.0048170969596,
"volume_molar": 18.26009469455695,
"formula_full": "Rb6 Os4 Br18",
"formula_reduced": "Rb3Os2Br9",
"formula_anonymous": "A2B3C9",
"energy_above_hull": 0.6753904960714284,
"spacegroup": 194
}
]
}