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=nelements&page=1231",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=nelements&page=1229",
"results": [
{
"id": "jvasp-8636",
"created_at": "2022-09-04T14:37:05.726680Z",
"updated_at": "2022-09-04T14:37:05.726708Z",
"structure_string": "Sm1 V1 O3\n1.0\n3.852683 -0.000000 -0.000000\n0.000000 3.852683 0.000000\n-0.000000 -0.000000 3.852683\nSm V O\n1 1 3\ndirect\n0.000000 0.000000 0.000000 Sm\n0.500000 0.500000 0.500000 V\n0.000000 0.500000 0.500000 O\n0.500000 0.000000 0.500000 O\n0.500000 0.500000 0.000000 O\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Sm",
"V",
"O"
],
"chemical_system": "O-Sm-V",
"density": 7.239040786793223,
"density_atomic": 0.08743396522441717,
"volume": 57.18601446436149,
"volume_molar": 6.887644572155618,
"formula_full": "Sm1 V1 O3",
"formula_reduced": "SmVO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 2.198584715,
"spacegroup": 221
},
{
"id": "jvasp-107010",
"created_at": "2022-09-04T14:36:52.783285Z",
"updated_at": "2022-09-04T14:36:52.783311Z",
"structure_string": "Si1 P1 Au1\n1.0\n3.367714 0.001495 5.131869\n1.534613 2.997743 5.131869\n0.002444 0.001495 6.138206\nSi P Au\n1 1 1\ndirect\n0.271929 0.271930 0.271930 Si\n0.998708 0.998715 0.998716 P\n0.136657 0.136658 0.136658 Au\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Si",
"P",
"Au"
],
"chemical_system": "Au-P-Si",
"density": 6.8678799711169916,
"density_atomic": 0.04846308643342808,
"volume": 61.90278458886409,
"volume_molar": 12.426242741003275,
"formula_full": "Si1 P1 Au1",
"formula_reduced": "SiPAu",
"formula_anonymous": "ABC",
"energy_above_hull": 1.86445389,
"spacegroup": 160
},
{
"id": "jvasp-97036",
"created_at": "2022-09-04T14:36:52.831164Z",
"updated_at": "2022-09-04T14:36:52.831192Z",
"structure_string": "Sr2 Fe4 As4\n1.0\n3.953274 -0.000000 0.000000\n0.000000 3.953274 0.000000\n0.000000 -0.000000 11.674296\nSr Fe As\n2 4 4\ndirect\n0.000000 0.000000 0.000000 Sr\n0.499999 0.499999 0.500000 Sr\n0.499999 0.000000 0.250000 Fe\n0.000000 0.499999 0.750000 Fe\n0.000000 0.499999 0.250000 Fe\n0.499999 0.000000 0.750000 Fe\n0.000000 0.000000 0.646231 As\n0.499999 0.499999 0.146231 As\n0.000000 0.000000 0.353769 As\n0.499999 0.499999 0.853769 As\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Sr",
"Fe",
"As"
],
"chemical_system": "As-Fe-Sr",
"density": 6.355512641580401,
"density_atomic": 0.05480945290317147,
"volume": 182.45027947398768,
"volume_molar": 10.987412646936924,
"formula_full": "Sr2 Fe4 As4",
"formula_reduced": "Sr(FeAs)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 2.213170162,
"spacegroup": 139
},
{
"id": "jvasp-107506",
"created_at": "2022-09-04T14:36:52.674940Z",
"updated_at": "2022-09-04T14:36:52.674970Z",
"structure_string": "Zr2 Ti4 Al2\n1.0\n5.908254 -0.010985 0.000000\n-2.958323 5.114285 0.000000\n-0.000000 -0.000000 4.786294\nZr Ti Al\n2 4 2\ndirect\n0.335365 0.166287 0.500000 Zr\n0.833712 0.664635 0.500000 Zr\n0.829238 0.170760 0.500000 Ti\n0.656825 0.835651 -0.000000 Ti\n0.164349 0.343175 -0.000000 Ti\n0.175366 0.824635 -0.000000 Ti\n0.334050 0.665951 0.500000 Al\n0.670888 0.329112 -0.000000 Al\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Zr",
"Ti",
"Al"
],
"chemical_system": "Al-Ti-Zr",
"density": 4.918062211179088,
"density_atomic": 0.055375015027525926,
"volume": 144.46948675360798,
"volume_molar": 10.875194809439783,
"formula_full": "Zr2 Ti4 Al2",
"formula_reduced": "ZrTi2Al",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.3473909916666678,
"spacegroup": 38
},
{
"id": "jvasp-104748",
"created_at": "2022-09-04T14:36:52.731917Z",
"updated_at": "2022-09-04T14:36:52.731949Z",
"structure_string": "Ce1 Nd1 N2\n1.0\n3.453079 0.000785 5.204122\n1.570083 3.075482 5.204122\n0.001282 0.000785 6.245529\nCe Nd N\n1 1 2\ndirect\n0.499999 0.500001 0.500000 Ce\n0.000000 0.000000 0.000000 Nd\n0.245246 0.245247 0.245246 N\n0.754752 0.754756 0.754754 N\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ce",
"Nd",
"N"
],
"chemical_system": "Ce-N-Nd",
"density": 7.824679928329,
"density_atomic": 0.0603401258202615,
"volume": 66.29087933815424,
"volume_molar": 9.980325161963512,
"formula_full": "Ce1 Nd1 N2",
"formula_reduced": "CeNdN2",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.108645875000001,
"spacegroup": 166
},
{
"id": "jvasp-100838",
"created_at": "2022-09-04T14:36:52.828788Z",
"updated_at": "2022-09-04T14:36:52.828822Z",
"structure_string": "Dy2 Al3 Co1\n1.0\n4.697063 -0.003396 2.574817\n1.523307 4.443191 2.574817\n-0.004757 -0.003396 5.356498\nDy Al Co\n2 3 1\ndirect\n0.626248 0.626246 0.626250 Dy\n0.373752 0.373751 0.373753 Dy\n0.000000 0.500000 0.000000 Al\n0.500000 -0.000000 0.000001 Al\n-0.000000 -0.000000 0.500001 Al\n0.000000 0.000000 0.000000 Co\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Dy",
"Al",
"Co"
],
"chemical_system": "Al-Co-Dy",
"density": 6.898564976508679,
"density_atomic": 0.05361941789401249,
"volume": 111.89976011787329,
"volume_molar": 11.231268440667785,
"formula_full": "Dy2 Al3 Co1",
"formula_reduced": "Dy2Al3Co",
"formula_anonymous": "AB2C3",
"energy_above_hull": 1.9859053833333336,
"spacegroup": 166
},
{
"id": "jvasp-107454",
"created_at": "2022-09-04T14:36:52.962304Z",
"updated_at": "2022-09-04T14:36:52.962319Z",
"structure_string": "La1 Ce1 Hg2\n1.0\n4.731486 0.000000 2.731724\n1.577162 4.460887 2.731724\n0.000000 0.000000 5.463449\nLa Ce Hg\n1 1 2\ndirect\n0.000000 0.000000 0.000000 La\n0.500000 0.500000 0.499999 Ce\n0.250000 0.250000 0.250000 Hg\n0.750000 0.750000 0.749999 Hg\n",
"nsites": 4,
"nelements": 3,
"elements": [
"La",
"Ce",
"Hg"
],
"chemical_system": "Ce-Hg-La",
"density": 9.79492215269039,
"density_atomic": 0.034687605104486575,
"volume": 115.31496590644221,
"volume_molar": 17.3610739105799,
"formula_full": "La1 Ce1 Hg2",
"formula_reduced": "LaCeHg2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0849899250000001,
"spacegroup": 225
},
{
"id": "jvasp-106402",
"created_at": "2022-09-04T14:36:52.966759Z",
"updated_at": "2022-09-04T14:36:52.966777Z",
"structure_string": "Tm2 Al2 O6\n1.0\n3.408610 0.000000 0.000000\n-1.704305 2.951942 0.000000\n-0.000000 -0.000000 11.471723\nTm Al O\n2 2 6\ndirect\n0.000000 0.000000 0.000000 Tm\n0.000000 0.000000 0.500000 Tm\n0.333334 0.666666 0.250000 Al\n0.666667 0.333333 0.750000 Al\n0.333334 0.666666 0.090701 O\n0.333334 0.666666 0.409299 O\n0.000000 0.000000 0.250000 O\n0.000000 0.000000 0.750000 O\n0.666667 0.333333 0.909299 O\n0.666667 0.333333 0.590701 O\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Tm",
"Al",
"O"
],
"chemical_system": "Al-O-Tm",
"density": 7.01781546521418,
"density_atomic": 0.08663357060226283,
"volume": 115.42869502528393,
"volume_molar": 6.951278491853715,
"formula_full": "Tm2 Al2 O6",
"formula_reduced": "TmAlO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.46900751,
"spacegroup": 194
},
{
"id": "jvasp-96974",
"created_at": "2022-09-04T14:36:53.012911Z",
"updated_at": "2022-09-04T14:36:53.012933Z",
"structure_string": "Rb2 Fe4 Se6\n1.0\n5.366296 0.000000 0.000000\n-0.000000 7.214818 -1.469129\n-0.000000 -0.034177 7.362797\nRb Fe Se\n2 4 6\ndirect\n0.250000 0.330039 0.669961 Rb\n0.750001 0.669961 0.330039 Rb\n0.000000 0.140612 0.140612 Fe\n0.500000 0.859388 0.859388 Fe\n0.000000 0.859388 0.859388 Fe\n0.500000 0.140612 0.140612 Fe\n0.750001 0.168642 0.391126 Se\n0.250000 0.831358 0.608874 Se\n0.750001 0.118793 0.881207 Se\n0.250000 0.881206 0.118794 Se\n0.750001 0.608874 0.831358 Se\n0.250000 0.391126 0.168642 Se\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Rb",
"Fe",
"Se"
],
"chemical_system": "Fe-Rb-Se",
"density": 5.061444821678738,
"density_atomic": 0.04213559258063139,
"volume": 284.794855490322,
"volume_molar": 14.292289229054814,
"formula_full": "Rb2 Fe4 Se6",
"formula_reduced": "RbFe2Se3",
"formula_anonymous": "AB2C3",
"energy_above_hull": 1.77359685,
"spacegroup": 63
},
{
"id": "jvasp-106741",
"created_at": "2022-09-04T14:36:53.044212Z",
"updated_at": "2022-09-04T14:36:53.044230Z",
"structure_string": "Sn4 Se2 S2\n1.0\n4.119707 0.000000 0.000000\n0.000000 4.491672 0.000000\n0.000000 0.000000 11.584746\nSn Se S\n4 2 2\ndirect\n-0.000000 0.109722 0.617735 Sn\n-0.000000 0.890278 0.117735 Sn\n0.500000 0.350242 0.376202 Sn\n0.500000 0.649757 0.876202 Sn\n-0.000000 0.773874 0.356492 Se\n-0.000000 0.226126 0.856492 Se\n0.500000 0.725673 0.649573 S\n0.500000 0.274326 0.149573 S\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Sn",
"Se",
"S"
],
"chemical_system": "S-Se-Sn",
"density": 5.398243241916069,
"density_atomic": 0.03731892341204117,
"volume": 214.3684562298695,
"volume_molar": 16.136962724002164,
"formula_full": "Sn4 Se2 S2",
"formula_reduced": "Sn2SeS",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.8973816916666666,
"spacegroup": 26
},
{
"id": "jvasp-2814",
"created_at": "2022-09-04T14:36:53.192361Z",
"updated_at": "2022-09-04T14:36:53.192383Z",
"structure_string": "Na4 Ag2 As2\n1.0\n5.649283 0.000000 0.000000\n0.000000 5.643829 -1.003605\n0.000000 0.003700 5.732366\nNa Ag As\n4 2 2\ndirect\n0.250070 0.674427 0.030744 Na\n0.750070 0.325574 0.969256 Na\n0.249929 0.030744 0.674427 Na\n0.749929 0.969256 0.325573 Na\n0.500000 0.499980 0.500020 Ag\n0.000000 0.500020 0.499980 Ag\n0.750000 0.790581 0.790580 As\n0.250000 0.209420 0.209419 As\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Na",
"Ag",
"As"
],
"chemical_system": "Ag-As-Na",
"density": 4.1564826867498486,
"density_atomic": 0.043766221421662754,
"volume": 182.78936906443283,
"volume_molar": 13.75979137422005,
"formula_full": "Na4 Ag2 As2",
"formula_reduced": "Na2AgAs",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0525417525,
"spacegroup": 63
},
{
"id": "jvasp-19048",
"created_at": "2022-09-04T14:36:52.696158Z",
"updated_at": "2022-09-04T14:36:52.696190Z",
"structure_string": "Na4 Ti6 O14\n1.0\n0.000000 8.599545 0.007796\n3.811660 0.000000 0.000000\n0.000000 -1.874579 -8.998636\nNa Ti O\n4 6 14\ndirect\n0.498691 0.750000 0.158169 Na\n0.501308 0.250000 0.841831 Na\n0.683353 0.750000 0.587584 Na\n0.316646 0.250000 0.412416 Na\n0.030162 0.750000 0.279721 Ti\n0.969837 0.250000 0.720279 Ti\n0.250163 0.750000 0.676648 Ti\n0.749836 0.250000 0.323352 Ti\n0.147780 0.750000 0.985507 Ti\n0.852219 0.250000 0.014493 Ti\n0.219809 0.750000 0.188956 O\n0.780190 0.250000 0.811044 O\n0.553998 0.250000 0.347105 O\n0.446001 0.750000 0.652895 O\n0.672886 0.250000 0.090462 O\n0.327113 0.750000 0.909538 O\n0.085505 0.250000 0.956823 O\n0.015310 0.750000 0.753951 O\n0.197794 0.250000 0.683901 O\n0.802205 0.750000 0.316099 O\n0.851526 0.250000 0.536485 O\n0.914494 0.750000 0.043177 O\n0.984690 0.250000 0.246049 O\n0.148473 0.750000 0.463515 O\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Na",
"Ti",
"O"
],
"chemical_system": "Na-O-Ti",
"density": 3.396190712315325,
"density_atomic": 0.08138173686474288,
"volume": 294.9064608916887,
"volume_molar": 7.399867577179935,
"formula_full": "Na4 Ti6 O14",
"formula_reduced": "Na2Ti3O7",
"formula_anonymous": "A2B3C7",
"energy_above_hull": 2.4922814583333337,
"spacegroup": 11
}
]
}