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=1574",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=density&page=1572",
"results": [
{
"id": "jvasp-25579",
"created_at": "2022-09-04T14:38:18.282604Z",
"updated_at": "2022-09-04T14:38:18.282629Z",
"structure_string": "Nb6 Sn2 S12\n1.0\n2.925960 -5.067912 0.000000\n2.925960 5.067912 -0.000000\n-0.000000 -0.000000 14.549861\nNb Sn S\n6 2 12\ndirect\n0.333333 0.666667 0.999425 Nb\n0.000000 0.000000 0.000000 Nb\n0.666667 0.333333 0.000575 Nb\n0.333333 0.666667 0.500575 Nb\n0.000000 0.000000 0.500000 Nb\n0.666667 0.333333 0.499425 Nb\n0.333333 0.666667 0.250000 Sn\n0.666667 0.333333 0.750000 Sn\n0.330769 0.333007 0.891974 S\n-0.002238 0.666993 0.108026 S\n0.330769 -0.002238 0.608026 S\n0.002238 0.333007 0.608026 S\n0.333007 0.002238 0.391974 S\n0.666993 0.669231 0.608026 S\n0.666993 -0.002238 0.891974 S\n0.002238 0.669231 0.891974 S\n-0.002238 0.330769 0.391974 S\n0.669231 0.666993 0.391974 S\n0.669231 0.002238 0.108026 S\n0.333007 0.330769 0.108026 S\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Nb",
"Sn",
"S"
],
"chemical_system": "Nb-S-Sn",
"density": 4.539538093569499,
"density_atomic": 0.04634935616756166,
"volume": 431.5054545244648,
"volume_molar": 12.992932929270529,
"formula_full": "Nb6 Sn2 S12",
"formula_reduced": "Nb3SnS6",
"formula_anonymous": "AB3C6",
"energy_above_hull": 3.27526799,
"spacegroup": 182
},
{
"id": "jvasp-108771",
"created_at": "2022-09-04T14:38:17.227249Z",
"updated_at": "2022-09-04T14:38:17.227283Z",
"structure_string": "K5 Bi4\n1.0\n6.453522 -0.014627 2.279994\n4.059614 5.016741 2.279994\n-0.018772 -0.008932 11.623816\nK Bi\n5 4\ndirect\n0.747696 0.747696 0.667452 K\n0.255009 0.255009 0.335079 K\n0.408565 0.408565 0.887678 K\n0.593924 0.593924 0.114759 K\n0.501865 0.501865 0.500913 K\n0.048519 0.048519 0.668865 Bi\n0.953936 0.953936 0.333718 Bi\n0.115575 0.115576 0.893210 Bi\n0.886908 0.886908 0.109325 Bi\n",
"nsites": 9,
"nelements": 2,
"elements": [
"K",
"Bi"
],
"chemical_system": "Bi-K",
"density": 4.539569014763654,
"density_atomic": 0.02385477869679935,
"volume": 377.28289641217884,
"volume_molar": 25.245007872607115,
"formula_full": "K5 Bi4",
"formula_reduced": "K5Bi4",
"formula_anonymous": "A4B5",
"energy_above_hull": 0.248060374074074,
"spacegroup": 12
},
{
"id": "jvasp-45299",
"created_at": "2022-09-04T14:38:34.363047Z",
"updated_at": "2022-09-04T14:38:34.363071Z",
"structure_string": "Ca4 Te4 O16\n1.0\n5.064668 -0.000000 0.000000\n0.000000 5.234770 0.000000\n0.000000 0.000000 12.785739\nCa Te O\n4 4 16\ndirect\n0.750000 0.000000 0.669078 Ca\n0.250000 0.500000 0.830922 Ca\n0.250000 0.000000 0.330922 Ca\n0.750000 0.500000 0.169078 Ca\n0.750000 0.500000 0.426866 Te\n0.250000 0.000000 0.073134 Te\n0.250000 0.500000 0.573134 Te\n0.750000 0.000000 0.926866 Te\n0.928313 0.794153 0.044065 O\n0.428313 0.705847 0.455935 O\n0.928313 0.705847 0.544065 O\n0.428313 0.794153 0.955935 O\n0.071687 0.205847 0.955935 O\n0.571687 0.294153 0.544065 O\n0.614885 0.278173 0.325352 O\n0.385116 0.721827 0.674649 O\n0.385116 0.778173 0.174649 O\n0.885116 0.721827 0.325352 O\n0.571687 0.205847 0.044065 O\n0.885116 0.778173 0.825352 O\n0.614885 0.221827 0.825352 O\n0.114885 0.278173 0.674649 O\n0.114885 0.221827 0.174649 O\n0.071687 0.294153 0.455935 O\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Ca",
"Te",
"O"
],
"chemical_system": "Ca-O-Te",
"density": 4.539572578098664,
"density_atomic": 0.07080058080780278,
"volume": 338.9802700227992,
"volume_molar": 8.505778753917104,
"formula_full": "Ca4 Te4 O16",
"formula_reduced": "CaTeO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 1.5476153644444448,
"spacegroup": 60
},
{
"id": "jvasp-16920",
"created_at": "2022-09-04T14:36:56.337903Z",
"updated_at": "2022-09-04T14:36:56.337912Z",
"structure_string": "Al1 Ni1 O3\n1.0\n3.656577 0.000000 0.000000\n0.000000 3.656577 -0.000000\n0.000000 -0.000000 3.656897\nAl Ni O\n1 1 3\ndirect\n0.000000 0.000000 0.000000 Al\n0.500000 0.500000 0.500000 Ni\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": [
"Al",
"Ni",
"O"
],
"chemical_system": "Al-Ni-O",
"density": 4.539740914288455,
"density_atomic": 0.10226048066033791,
"volume": 48.89474377308758,
"volume_molar": 5.889020588513339,
"formula_full": "Al1 Ni1 O3",
"formula_reduced": "AlNiO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.94893514,
"spacegroup": 221
},
{
"id": "jvasp-58427",
"created_at": "2022-09-04T14:37:47.011390Z",
"updated_at": "2022-09-04T14:37:47.011410Z",
"structure_string": "Nb6 Sn2 S12\n1.0\n2.924825 -5.065944 0.000000\n2.924825 5.065944 -0.000000\n0.000000 -0.000000 14.560511\nNb Sn S\n6 2 12\ndirect\n0.000000 0.000000 0.250000 Nb\n0.000000 0.000000 0.750000 Nb\n0.333332 0.666666 0.250000 Nb\n0.666666 0.333332 0.750000 Nb\n0.666666 0.333332 0.250000 Nb\n0.333332 0.666666 0.750000 Nb\n0.000000 0.000000 0.500000 Sn\n0.000000 0.000000 0.000000 Sn\n0.663719 0.663719 0.358038 S\n0.663719 -0.000000 0.858038 S\n0.336280 0.336280 0.858038 S\n0.336280 0.336280 0.641962 S\n-0.000000 0.663719 0.641962 S\n0.663719 0.663719 0.141962 S\n0.663719 -0.000000 0.641962 S\n0.336280 -0.000000 0.141962 S\n-0.000000 0.336280 0.358038 S\n-0.000000 0.336280 0.141962 S\n0.336280 -0.000000 0.358038 S\n-0.000000 0.663719 0.858038 S\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Nb",
"Sn",
"S"
],
"chemical_system": "Nb-S-Sn",
"density": 4.539740948066344,
"density_atomic": 0.04635142734201391,
"volume": 431.4861730670283,
"volume_molar": 12.992352351016827,
"formula_full": "Nb6 Sn2 S12",
"formula_reduced": "Nb3SnS6",
"formula_anonymous": "AB3C6",
"energy_above_hull": 3.27525799,
"spacegroup": 193
},
{
"id": "jvasp-119338",
"created_at": "2022-09-04T14:38:26.030875Z",
"updated_at": "2022-09-04T14:38:26.030906Z",
"structure_string": "Mn4 O4 F4\n1.0\n5.085214 -0.000066 -0.125255\n0.000046 4.572461 -0.000031\n0.166015 0.000037 5.654887\nMn O F\n4 4 4\ndirect\n0.224345 0.481947 0.655125 Mn\n0.224347 0.018053 0.155128 Mn\n0.775653 0.981945 0.844872 Mn\n0.775653 0.518052 0.344874 Mn\n0.082595 0.219464 0.885502 O\n0.082593 0.280538 0.385503 O\n0.917407 0.719461 0.614497 O\n0.917404 0.780535 0.114497 O\n0.427589 0.758234 0.880310 F\n0.427592 0.741764 0.380310 F\n0.572408 0.258236 0.619689 F\n0.572410 0.241766 0.119691 F\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Mn",
"O",
"F"
],
"chemical_system": "F-Mn-O",
"density": 4.539884625732037,
"density_atomic": 0.091197753088294,
"volume": 131.58218918378483,
"volume_molar": 6.603387206447515,
"formula_full": "Mn4 O4 F4",
"formula_reduced": "MnOF",
"formula_anonymous": "ABC",
"energy_above_hull": 1.22313700795977,
"spacegroup": 14
},
{
"id": "jvasp-120423",
"created_at": "2022-09-04T14:38:37.140411Z",
"updated_at": "2022-09-04T14:38:37.140437Z",
"structure_string": "Li8 Mn2 Co4 O14\n1.0\n4.838930 -0.040840 -0.804163\n-0.954443 4.793687 -0.918620\n-0.006648 0.092564 9.854093\nLi Mn Co O\n8 2 4 14\ndirect\n0.291450 0.570429 0.081841 Li\n0.413310 0.858908 0.354638 Li\n0.867261 0.716353 0.221465 Li\n0.009785 0.004740 0.493684 Li\n0.570451 0.137643 0.639262 Li\n0.142014 0.287772 0.781439 Li\n0.711540 0.426351 0.928622 Li\n0.143391 0.288493 0.287952 Li\n0.002212 0.003858 0.004922 Mn\n0.711391 0.424797 0.424006 Mn\n0.572356 0.143757 0.144603 Co\n0.856502 0.713057 0.713204 Co\n0.285112 0.570793 0.570082 Co\n0.428047 0.856724 0.856797 Co\n0.352566 0.189770 0.968190 O\n0.072132 0.666873 0.886951 O\n0.215439 0.935769 0.166112 O\n0.647004 0.810816 0.031060 O\n0.766383 0.090454 0.319961 O\n0.374247 0.241240 0.469677 O\n0.932707 0.381146 0.602700 O\n0.503238 0.529891 0.746163 O\n0.519549 0.483299 0.253705 O\n0.638155 0.759576 0.540209 O\n0.062477 0.634086 0.403922 O\n0.210587 0.899916 0.684827 O\n0.784093 0.044829 0.824127 O\n0.916604 0.328658 0.099879 O\n",
"nsites": 28,
"nelements": 4,
"elements": [
"Li",
"Mn",
"Co",
"O"
],
"chemical_system": "Co-Li-Mn-O",
"density": 4.539885908792718,
"density_atomic": 0.12245727596170326,
"volume": 228.65117470648778,
"volume_molar": 4.9177484250779315,
"formula_full": "Li8 Mn2 Co4 O14",
"formula_reduced": "Li4MnCo2O7",
"formula_anonymous": "AB2C4D7",
"energy_above_hull": 2.5529059672413794,
"spacegroup": 1
},
{
"id": "jvasp-76910",
"created_at": "2022-09-04T14:38:08.471622Z",
"updated_at": "2022-09-04T14:38:08.471646Z",
"structure_string": "Sr2 Cd1 Hg1\n1.0\n-11.525511 0.000000 -6.654257\n-7.720567 0.352442 0.063900\n-6.581502 3.574205 -1.909018\nSr Cd Hg\n2 1 1\ndirect\n0.742233 -0.000001 0.000000 Sr\n0.257767 -0.000000 0.000000 Sr\n0.000000 0.000000 0.000000 Cd\n0.500000 -0.000000 0.000000 Hg\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sr",
"Cd",
"Hg"
],
"chemical_system": "Cd-Hg-Sr",
"density": 4.540066624687703,
"density_atomic": 0.022399528333831756,
"volume": 178.57518874442047,
"volume_molar": 26.88512307156169,
"formula_full": "Sr2 Cd1 Hg1",
"formula_reduced": "Sr2CdHg",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 71
},
{
"id": "jvasp-75513",
"created_at": "2022-09-04T14:35:46.631820Z",
"updated_at": "2022-09-04T14:35:46.631848Z",
"structure_string": "Be1 As1 Br1\n1.0\n-0.000000 3.105917 3.105917\n3.105917 0.000000 3.105917\n3.105917 3.105917 0.000000\nBe As Br\n1 1 1\ndirect\n0.750001 0.750001 0.750001 Be\n0.500000 0.500000 0.500000 As\n0.000000 0.000000 0.000000 Br\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Be",
"As",
"Br"
],
"chemical_system": "As-Be-Br",
"density": 4.54008124142122,
"density_atomic": 0.05006355916205445,
"volume": 59.923825836854256,
"volume_molar": 12.028990468908704,
"formula_full": "Be1 As1 Br1",
"formula_reduced": "BeAsBr",
"formula_anonymous": "ABC",
"energy_above_hull": 1.414523985,
"spacegroup": 216
},
{
"id": "jvasp-36255",
"created_at": "2022-09-04T14:37:29.217590Z",
"updated_at": "2022-09-04T14:37:29.217618Z",
"structure_string": "Na1 Cu1 O1\n1.0\n2.656699 2.656699 -0.000000\n2.656699 0.000000 -2.656699\n-0.000000 2.656699 -2.656699\nNa Cu O\n1 1 1\ndirect\n0.500000 0.500000 0.500000 Na\n0.000000 0.000000 0.000000 Cu\n0.750000 0.750000 0.750000 O\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Na",
"Cu",
"O"
],
"chemical_system": "Cu-Na-O",
"density": 4.540094553339613,
"density_atomic": 0.07999525040634618,
"volume": 37.50222650421261,
"volume_molar": 7.528122894059036,
"formula_full": "Na1 Cu1 O1",
"formula_reduced": "NaCuO",
"formula_anonymous": "ABC",
"energy_above_hull": 0.1664433333333333,
"spacegroup": 216
},
{
"id": "jvasp-58439",
"created_at": "2022-09-04T14:38:28.391379Z",
"updated_at": "2022-09-04T14:38:28.391401Z",
"structure_string": "Yb2 P10\n1.0\n0.000000 4.662099 0.022771\n9.735851 0.000000 0.000000\n0.000000 -1.491719 -5.291870\nYb P\n2 10\ndirect\n0.924504 0.250000 0.616707 Yb\n0.075496 0.750000 0.383293 Yb\n0.720490 0.250000 0.072440 P\n0.279511 0.750000 0.927560 P\n0.365800 0.408756 0.023464 P\n0.634201 0.908756 0.976536 P\n0.634201 0.591244 0.976536 P\n0.365800 0.091244 0.023464 P\n0.305169 0.439816 0.408803 P\n0.694831 0.939816 0.591197 P\n0.694831 0.560184 0.591197 P\n0.305169 0.060184 0.408803 P\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Yb",
"P"
],
"chemical_system": "P-Yb",
"density": 4.540105662042578,
"density_atomic": 0.05002821736605719,
"volume": 239.8646330369085,
"volume_molar": 12.037488195783409,
"formula_full": "Yb2 P10",
"formula_reduced": "YbP5",
"formula_anonymous": "AB5",
"energy_above_hull": 2.5285047,
"spacegroup": 11
},
{
"id": "jvasp-119261",
"created_at": "2022-09-04T14:38:26.705525Z",
"updated_at": "2022-09-04T14:38:26.705539Z",
"structure_string": "Al2 V4 O8\n1.0\n5.071856 -0.056717 2.910066\n1.748081 4.754033 2.897335\n0.029957 0.007777 5.847422\nAl V O\n2 4 8\ndirect\n0.624981 0.625015 0.625016 Al\n0.375008 0.374978 0.374995 Al\n0.999998 -0.000000 0.000008 V\n0.000001 0.000002 0.499990 V\n0.999991 0.500010 0.000000 V\n0.500017 0.999989 -0.000003 V\n0.251857 0.748106 0.751983 O\n0.248001 0.251936 0.748158 O\n0.251914 0.748152 0.251932 O\n0.251945 0.248017 0.251895 O\n0.752001 0.748060 0.251856 O\n0.748133 0.251906 0.248015 O\n0.748100 0.251842 0.748062 O\n0.748061 0.751982 0.748090 O\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Al",
"V",
"O"
],
"chemical_system": "Al-O-V",
"density": 4.5401347178298055,
"density_atomic": 0.0992363321470904,
"volume": 141.077362464877,
"volume_molar": 6.068483820093071,
"formula_full": "Al2 V4 O8",
"formula_reduced": "AlV2O4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 2.886187885714285,
"spacegroup": 227
}
]
}