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=density&page=3597",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=density&page=3595",
"results": [
{
"id": "jvasp-67127",
"created_at": "2022-09-04T14:35:54.562455Z",
"updated_at": "2022-09-04T14:35:54.562472Z",
"structure_string": "Be1 In1 Pd1\n1.0\n-1.581638 1.581638 4.621819\n1.581638 -1.581638 4.621819\n1.581638 1.581638 -4.621819\nBe In Pd\n1 1 1\ndirect\n0.038211 0.038211 0.000000 Be\n0.332476 0.332476 0.000000 In\n0.629313 0.629313 0.000000 Pd\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Be",
"In",
"Pd"
],
"chemical_system": "Be-In-Pd",
"density": 8.267267180799827,
"density_atomic": 0.06486854374843898,
"volume": 46.24737702813304,
"volume_molar": 9.283607141473588,
"formula_full": "Be1 In1 Pd1",
"formula_reduced": "BeInPd",
"formula_anonymous": "ABC",
"energy_above_hull": 0.8173905899999999,
"spacegroup": 107
},
{
"id": "jvasp-37151",
"created_at": "2022-09-04T14:38:03.646328Z",
"updated_at": "2022-09-04T14:38:03.646348Z",
"structure_string": "Nb3 Cr1\n1.0\n3.214372 3.214372 -0.000000\n3.214372 -0.000000 -3.214372\n0.000000 3.214372 -3.214372\nNb Cr\n3 1\ndirect\n0.250000 0.250000 0.250000 Nb\n0.750000 0.750000 0.750000 Nb\n0.500000 0.500000 0.500000 Nb\n0.000000 0.000000 0.000000 Cr\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Nb",
"Cr"
],
"chemical_system": "Cr-Nb",
"density": 8.267703650928974,
"density_atomic": 0.06022011584959471,
"volume": 66.42298746137202,
"volume_molar": 10.000214504802432,
"formula_full": "Nb3 Cr1",
"formula_reduced": "Nb3Cr",
"formula_anonymous": "AB3",
"energy_above_hull": 5.3332514,
"spacegroup": 225
},
{
"id": "jvasp-94291",
"created_at": "2022-09-04T14:36:10.463443Z",
"updated_at": "2022-09-04T14:36:10.463456Z",
"structure_string": "Tb2 Sn4\n1.0\n0.000000 0.000000 -4.354582\n-4.430455 0.000000 0.000000\n2.215227 8.251975 0.000000\nTb Sn\n2 4\ndirect\n0.750000 0.099337 0.198674 Tb\n0.250000 0.900662 0.801327 Tb\n0.750000 0.437230 0.874462 Sn\n0.250000 0.562769 0.125539 Sn\n0.750000 0.748780 0.497562 Sn\n0.250000 0.251219 0.502439 Sn\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Tb",
"Sn"
],
"chemical_system": "Sn-Tb",
"density": 8.26799402370731,
"density_atomic": 0.03768760539071109,
"volume": 159.20353489688225,
"volume_molar": 15.979101610643285,
"formula_full": "Tb2 Sn4",
"formula_reduced": "TbSn2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.4643739333333335,
"spacegroup": 63
},
{
"id": "jvasp-99017",
"created_at": "2022-09-04T14:36:19.205320Z",
"updated_at": "2022-09-04T14:36:19.205345Z",
"structure_string": "Tb4 Fe4 O12\n1.0\n5.152636 0.000000 0.000000\n0.000000 5.539015 0.000000\n0.000000 0.000000 7.396161\nTb Fe O\n4 4 12\ndirect\n0.979016 0.072853 0.250000 Tb\n0.520985 0.572854 0.250000 Tb\n0.020984 0.927147 0.750000 Tb\n0.479016 0.427147 0.750000 Tb\n0.500000 0.000000 0.000000 Fe\n0.000000 0.500000 0.000000 Fe\n0.000000 0.500000 0.500000 Fe\n0.500000 0.000000 0.500000 Fe\n0.903471 0.526026 0.750000 O\n0.403470 0.973975 0.250000 O\n0.691845 0.300912 0.451626 O\n0.691845 0.300912 0.048374 O\n0.191844 0.199088 0.951626 O\n0.808156 0.800913 0.451626 O\n0.308156 0.699088 0.548374 O\n0.308156 0.699088 0.951626 O\n0.808156 0.800913 0.048374 O\n0.191844 0.199088 0.548374 O\n0.096530 0.473975 0.250000 O\n0.596530 0.026026 0.750000 O\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Tb",
"Fe",
"O"
],
"chemical_system": "Fe-O-Tb",
"density": 8.268259761866293,
"density_atomic": 0.09474616376923753,
"volume": 211.0903408048449,
"volume_molar": 6.356078727015738,
"formula_full": "Tb4 Fe4 O12",
"formula_reduced": "TbFeO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 2.04998688,
"spacegroup": 62
},
{
"id": "jvasp-35054",
"created_at": "2022-09-04T14:37:35.398226Z",
"updated_at": "2022-09-04T14:37:35.398243Z",
"structure_string": "Ru2 N4\n1.0\n4.407318 0.000000 0.000000\n0.000000 4.407318 0.000000\n0.000000 0.000000 2.668823\nRu N\n2 4\ndirect\n0.500000 0.500000 0.000000 Ru\n0.000000 0.000000 0.000000 Ru\n0.893487 0.393487 0.499999 N\n0.106514 0.606514 0.499999 N\n0.393487 0.106514 0.499999 N\n0.606514 0.893487 0.499999 N\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Ru",
"N"
],
"chemical_system": "N-Ru",
"density": 8.269532208756875,
"density_atomic": 0.11573979380237318,
"volume": 51.84042413489226,
"volume_molar": 5.203172186640373,
"formula_full": "Ru2 N4",
"formula_reduced": "RuN2",
"formula_anonymous": "AB2",
"energy_above_hull": 4.618535666666666,
"spacegroup": 127
},
{
"id": "jvasp-123369",
"created_at": "2022-09-04T14:38:53.259101Z",
"updated_at": "2022-09-04T14:38:53.259126Z",
"structure_string": "Zr1 Ag1\n1.0\n1.507638 -2.611303 -0.000000\n1.507638 2.611303 -0.000000\n0.000000 -0.000000 5.077273\nZr Ag\n1 1\ndirect\n0.333334 0.666667 0.750000 Zr\n0.666667 0.333334 0.250000 Ag\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Zr",
"Ag"
],
"chemical_system": "Ag-Zr",
"density": 8.269675891456712,
"density_atomic": 0.05002823041298556,
"volume": 39.9774284137156,
"volume_molar": 12.037485056510942,
"formula_full": "Zr1 Ag1",
"formula_reduced": "ZrAg",
"formula_anonymous": "AB",
"energy_above_hull": 1.36538088,
"spacegroup": 187
},
{
"id": "jvasp-18342",
"created_at": "2022-09-04T14:38:06.625990Z",
"updated_at": "2022-09-04T14:38:06.626021Z",
"structure_string": "Pr1 Bi1\n1.0\n4.011106 -0.000000 2.315814\n1.337035 3.781707 2.315814\n-0.000000 -0.000000 4.631626\nPr Bi\n1 1\ndirect\n0.500001 0.500000 0.499999 Pr\n0.000000 0.000000 0.000000 Bi\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Pr",
"Bi"
],
"chemical_system": "Bi-Pr",
"density": 8.269756225451658,
"density_atomic": 0.028467183179172063,
"volume": 70.25633647741076,
"volume_molar": 21.154677377444507,
"formula_full": "Pr1 Bi1",
"formula_reduced": "PrBi",
"formula_anonymous": "AB",
"energy_above_hull": 0.3579270750000001,
"spacegroup": 225
},
{
"id": "jvasp-86524",
"created_at": "2022-09-04T14:35:47.495848Z",
"updated_at": "2022-09-04T14:35:47.495873Z",
"structure_string": "Sc2 Re4 O12\n1.0\n4.852404 0.000000 0.000000\n0.000000 5.621490 -0.754726\n0.000000 -0.024297 7.561083\nSc Re O\n2 4 12\ndirect\n0.500000 -0.000000 0.500000 Sc\n0.000000 0.500000 0.499999 Sc\n0.008832 0.870631 0.848991 Re\n0.991167 0.129368 0.151008 Re\n0.491168 0.370631 0.848991 Re\n0.508832 0.629368 0.151008 Re\n0.821956 0.824367 0.616782 O\n0.732560 0.657169 0.930330 O\n0.716686 0.922869 0.248424 O\n0.321956 0.675632 0.383217 O\n0.216686 0.577130 0.751575 O\n0.783313 0.422869 0.248424 O\n0.178043 0.175632 0.383217 O\n0.232560 0.842831 0.069669 O\n0.767439 0.157169 0.930330 O\n0.678043 0.324367 0.616782 O\n0.283313 0.077130 0.751575 O\n0.267439 0.342831 0.069669 O\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Sc",
"Re",
"O"
],
"chemical_system": "O-Re-Sc",
"density": 8.26992299629384,
"density_atomic": 0.08731070833827498,
"volume": 206.16027910644289,
"volume_molar": 6.897367888332701,
"formula_full": "Sc2 Re4 O12",
"formula_reduced": "Sc(ReO3)2",
"formula_anonymous": "AB2C6",
"energy_above_hull": 3.817061361111112,
"spacegroup": 14
},
{
"id": "jvasp-85925",
"created_at": "2022-09-04T14:37:40.416982Z",
"updated_at": "2022-09-04T14:37:40.416999Z",
"structure_string": "Sc2 Re4 O12\n1.0\n4.852172 0.000000 0.000000\n0.000000 5.621637 -0.754692\n0.000000 -0.024240 7.561171\nSc Re O\n2 4 12\ndirect\n0.500000 -0.000000 0.500000 Sc\n0.000000 0.500000 0.500000 Sc\n0.008837 0.870634 0.848994 Re\n0.991162 0.129366 0.151006 Re\n0.491163 0.370634 0.848994 Re\n0.508837 0.629366 0.151006 Re\n0.821927 0.824346 0.616792 O\n0.732633 0.657122 0.930349 O\n0.716737 0.922823 0.248436 O\n0.321927 0.675654 0.383208 O\n0.216737 0.577178 0.751564 O\n0.783263 0.422823 0.248436 O\n0.178073 0.175654 0.383208 O\n0.232634 0.842878 0.069651 O\n0.767366 0.157122 0.930349 O\n0.678073 0.324346 0.616792 O\n0.283263 0.077177 0.751564 O\n0.267366 0.342878 0.069651 O\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Sc",
"Re",
"O"
],
"chemical_system": "O-Re-Sc",
"density": 8.269997231533962,
"density_atomic": 0.08731149208576591,
"volume": 206.15842851842038,
"volume_molar": 6.8973059744351435,
"formula_full": "Sc2 Re4 O12",
"formula_reduced": "Sc(ReO3)2",
"formula_anonymous": "AB2C6",
"energy_above_hull": 3.817061361111112,
"spacegroup": 14
},
{
"id": "jvasp-59672",
"created_at": "2022-09-04T14:37:39.625149Z",
"updated_at": "2022-09-04T14:37:39.625171Z",
"structure_string": "Nd1 Mn12\n1.0\n4.301302 0.000000 1.689321\n2.150651 5.908660 0.844660\n-0.009336 0.000000 6.344362\nNd Mn\n1 12\ndirect\n0.000000 0.000000 0.000000 Nd\n0.732679 0.767319 0.767319 Mn\n0.499999 -0.000000 0.500000 Mn\n-0.000000 0.500000 0.000000 Mn\n0.500000 0.500000 -0.000000 Mn\n-0.000000 -0.000000 0.500000 Mn\n0.367162 0.632837 0.632837 Mn\n-0.000001 0.367163 0.632837 Mn\n-0.000001 0.632837 0.367163 Mn\n0.632836 0.367163 0.367163 Mn\n0.267319 0.232681 0.232681 Mn\n0.499999 0.767319 0.232681 Mn\n0.499999 0.232681 0.767319 Mn\n",
"nsites": 13,
"nelements": 2,
"elements": [
"Nd",
"Mn"
],
"chemical_system": "Mn-Nd",
"density": 8.270016440898418,
"density_atomic": 0.08057782413065746,
"volume": 161.33471138312714,
"volume_molar": 7.473694934024354,
"formula_full": "Nd1 Mn12",
"formula_reduced": "NdMn12",
"formula_anonymous": "AB12",
"energy_above_hull": 4.96511526127321,
"spacegroup": 139
},
{
"id": "jvasp-110483",
"created_at": "2022-09-04T14:38:39.201050Z",
"updated_at": "2022-09-04T14:38:39.201067Z",
"structure_string": "Yb2 Al2 O5\n1.0\n3.664332 0.000000 0.000000\n0.000000 3.664332 0.000000\n0.000000 0.000000 7.178431\nYb Al O\n2 2 5\ndirect\n0.000000 0.000000 0.000000 Yb\n0.000000 0.000000 0.500000 Yb\n0.500000 0.500000 0.253837 Al\n0.500000 0.500000 0.746163 Al\n0.500000 0.000000 0.211253 O\n0.500000 0.000000 0.788747 O\n0.500000 0.500000 0.500000 O\n0.000000 0.500000 0.211253 O\n0.000000 0.500000 0.788747 O\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Yb",
"Al",
"O"
],
"chemical_system": "Al-O-Yb",
"density": 8.270036640238924,
"density_atomic": 0.09337343777841248,
"volume": 96.38715478547755,
"volume_molar": 6.4495223730450375,
"formula_full": "Yb2 Al2 O5",
"formula_reduced": "Yb2Al2O5",
"formula_anonymous": "A2B2C5",
"energy_above_hull": 1.4418838333333333,
"spacegroup": 123
},
{
"id": "jvasp-64928",
"created_at": "2022-09-04T14:36:17.237216Z",
"updated_at": "2022-09-04T14:36:17.237235Z",
"structure_string": "Be1 Ni4 Rh1\n1.0\n-0.000000 3.264953 3.264953\n3.264953 0.000000 3.264953\n3.264953 3.264953 0.000000\nBe Ni Rh\n1 4 1\ndirect\n0.000000 0.000000 0.000000 Be\n0.124336 0.625220 0.625220 Ni\n0.625220 0.625220 0.625220 Ni\n0.625220 0.124336 0.625220 Ni\n0.625220 0.625220 0.124336 Ni\n0.250000 0.250000 0.250000 Rh\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Be",
"Ni",
"Rh"
],
"chemical_system": "Be-Ni-Rh",
"density": 8.270489624232372,
"density_atomic": 0.08619666303889136,
"volume": 69.60826310982411,
"volume_molar": 6.986512641774603,
"formula_full": "Be1 Ni4 Rh1",
"formula_reduced": "BeNi4Rh",
"formula_anonymous": "ABC4",
"energy_above_hull": 1.6660897833333337,
"spacegroup": 216
}
]
}