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=4135",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=formula_reduced&page=4133",
"results": [
{
"id": "jvasp-113737",
"created_at": "2022-09-04T14:38:47.009112Z",
"updated_at": "2022-09-04T14:38:47.009128Z",
"structure_string": "Tl1 P1 Se1\n1.0\n2.971527 -0.000000 -0.000000\n-0.000000 2.971527 0.000000\n-0.000000 0.000000 8.652326\nTl P Se\n1 1 1\ndirect\n0.000000 0.000000 0.637307 Tl\n0.000000 0.000000 0.284030 P\n0.000000 0.000000 0.017252 Se\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Tl",
"P",
"Se"
],
"chemical_system": "P-Se-Tl",
"density": 6.831637567839293,
"density_atomic": 0.03926711722927381,
"volume": 76.39980247298334,
"volume_molar": 15.336345484283392,
"formula_full": "Tl1 P1 Se1",
"formula_reduced": "TlPSe",
"formula_anonymous": "ABC",
"energy_above_hull": 1.2196904888888889,
"spacegroup": 99
},
{
"id": "jvasp-113736",
"created_at": "2022-09-04T14:38:51.275729Z",
"updated_at": "2022-09-04T14:38:51.275751Z",
"structure_string": "Tl1 P1 Se1\n1.0\n6.477130 -0.000000 0.000000\n-0.000000 6.477130 0.000000\n0.000000 0.000000 4.762595\nTl P Se\n1 1 1\ndirect\n-0.014104 0.354589 0.000000 Tl\n-0.048150 -0.068006 0.000000 P\n0.322087 -0.014556 0.000000 Se\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Tl",
"P",
"Se"
],
"chemical_system": "P-Se-Tl",
"density": 2.6122105236626423,
"density_atomic": 0.015014551905253628,
"volume": 199.80616264347475,
"volume_molar": 40.10869453848196,
"formula_full": "Tl1 P1 Se1",
"formula_reduced": "TlPSe",
"formula_anonymous": "ABC",
"energy_above_hull": 1.3671971555555555,
"spacegroup": 6
},
{
"id": "jvasp-16609",
"created_at": "2022-09-04T14:37:56.054838Z",
"updated_at": "2022-09-04T14:37:56.054863Z",
"structure_string": "Tl3 Pt3\n1.0\n3.308335 -5.730204 0.000000\n3.308335 5.730204 -0.000000\n0.000000 -0.000000 3.946721\nTl Pt\n3 3\ndirect\n-0.000000 0.499999 0.000000 Tl\n0.499999 0.499999 0.000000 Tl\n0.499999 -0.000000 0.000000 Tl\n0.000000 0.000000 0.000000 Pt\n0.333332 0.666666 0.500000 Pt\n0.666666 0.333332 0.500000 Pt\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Tl",
"Pt"
],
"chemical_system": "Pt-Tl",
"density": 13.298590135530645,
"density_atomic": 0.04009638923305564,
"volume": 149.63940930256067,
"volume_molar": 15.01915976772123,
"formula_full": "Tl3 Pt3",
"formula_reduced": "TlPt",
"formula_anonymous": "AB",
"energy_above_hull": 0.927017,
"spacegroup": 191
},
{
"id": "jvasp-13733",
"created_at": "2022-09-04T14:36:33.755761Z",
"updated_at": "2022-09-04T14:36:33.755789Z",
"structure_string": "Tl3 Pt3\n1.0\n3.308522 -5.730529 -0.000000\n3.308522 5.730529 -0.000000\n0.000000 0.000000 3.946576\nTl Pt\n3 3\ndirect\n-0.000000 0.500000 -0.000000 Tl\n0.500000 0.500000 0.000000 Tl\n0.500000 -0.000000 0.000000 Tl\n0.000000 0.000000 0.000000 Pt\n0.333333 0.666667 0.500001 Pt\n0.666667 0.333333 0.500001 Pt\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Tl",
"Pt"
],
"chemical_system": "Pt-Tl",
"density": 13.297572863351574,
"density_atomic": 0.040093322070233695,
"volume": 149.65085680576598,
"volume_molar": 15.020308742315445,
"formula_full": "Tl3 Pt3",
"formula_reduced": "TlPt",
"formula_anonymous": "AB",
"energy_above_hull": 0.927017,
"spacegroup": 191
},
{
"id": "jvasp-4630",
"created_at": "2022-09-04T14:36:53.303017Z",
"updated_at": "2022-09-04T14:36:53.303026Z",
"structure_string": "Tl2 Pt4 S6\n1.0\n3.596844 -6.229916 0.000000\n3.596844 6.229916 0.000000\n-0.000000 0.000000 5.932069\nTl Pt S\n2 4 6\ndirect\n0.666667 0.333332 0.623707 Tl\n0.333332 0.666667 0.376294 Tl\n0.000000 0.000000 0.000000 Pt\n0.500000 0.500000 -0.000000 Pt\n-0.000000 0.500000 -0.000000 Pt\n0.500000 -0.000000 0.000000 Pt\n0.830417 0.660836 0.199038 S\n0.339163 0.169582 0.199038 S\n0.830418 0.169581 0.199038 S\n0.169581 0.830418 0.800962 S\n0.169582 0.339163 0.800962 S\n0.660836 0.830417 0.800962 S\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Tl",
"Pt",
"S"
],
"chemical_system": "Pt-S-Tl",
"density": 8.628944536746106,
"density_atomic": 0.04513789096964481,
"volume": 265.85203123623984,
"volume_molar": 13.34165294530461,
"formula_full": "Tl2 Pt4 S6",
"formula_reduced": "TlPt2S3",
"formula_anonymous": "AB2C3",
"energy_above_hull": 1.8224909,
"spacegroup": 164
},
{
"id": "jvasp-29338",
"created_at": "2022-09-04T14:37:03.585771Z",
"updated_at": "2022-09-04T14:37:03.585791Z",
"structure_string": "Tl2 Pt4 Se6\n1.0\n7.533876 -0.000000 -0.000000\n-3.766938 6.524528 0.000000\n0.000000 0.000000 5.853702\nTl Pt Se\n2 4 6\ndirect\n0.333333 0.666667 0.349153 Tl\n0.666667 0.333333 0.650847 Tl\n0.000000 0.000000 0.000000 Pt\n0.500000 0.000000 0.000000 Pt\n-0.000000 0.500000 0.000000 Pt\n0.500000 0.500000 0.000000 Pt\n0.169259 0.830741 0.783033 Se\n0.169259 0.338518 0.783033 Se\n0.661482 0.830741 0.783033 Se\n0.338518 0.169259 0.216967 Se\n0.830741 0.661482 0.216967 Se\n0.830741 0.169259 0.216967 Se\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Tl",
"Pt",
"Se"
],
"chemical_system": "Pt-Se-Tl",
"density": 9.59637667102841,
"density_atomic": 0.04170451445757543,
"volume": 287.7386334807276,
"volume_molar": 14.440021274258253,
"formula_full": "Tl2 Pt4 Se6",
"formula_reduced": "TlPt2Se3",
"formula_anonymous": "AB2C3",
"energy_above_hull": 1.5521209166666667,
"spacegroup": 164
},
{
"id": "jvasp-107995",
"created_at": "2022-09-04T14:36:16.426130Z",
"updated_at": "2022-09-04T14:36:16.426157Z",
"structure_string": "Tl2 Rh6\n1.0\n5.686065 -0.000000 0.000000\n-2.843032 4.924277 0.000000\n-0.000000 -0.000000 4.580877\nTl Rh\n2 6\ndirect\n0.333334 0.666667 0.750001 Tl\n0.666667 0.333334 0.250000 Tl\n0.160579 0.321158 0.250000 Rh\n0.678844 0.839422 0.250000 Rh\n0.160579 0.839422 0.250000 Rh\n0.839423 0.678843 0.750001 Rh\n0.321158 0.160578 0.750001 Rh\n0.839423 0.160578 0.750001 Rh\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Tl",
"Rh"
],
"chemical_system": "Rh-Tl",
"density": 13.285503338302764,
"density_atomic": 0.06237162532385155,
"volume": 128.26345246675362,
"volume_molar": 9.655257063979494,
"formula_full": "Tl2 Rh6",
"formula_reduced": "TlRh3",
"formula_anonymous": "AB3",
"energy_above_hull": 2.0471804,
"spacegroup": 194
},
{
"id": "jvasp-16279",
"created_at": "2022-09-04T14:37:53.858868Z",
"updated_at": "2022-09-04T14:37:53.858892Z",
"structure_string": "Tl1 S1\n1.0\n3.605153 0.000000 0.000000\n-0.000000 3.605153 0.000000\n0.000000 0.000000 3.605153\nTl S\n1 1\ndirect\n0.500000 0.500000 0.500000 Tl\n0.000000 0.000000 0.000000 S\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Tl",
"S"
],
"chemical_system": "S-Tl",
"density": 8.379424487949553,
"density_atomic": 0.0426833889452043,
"volume": 46.856635553646925,
"volume_molar": 14.108862742204114,
"formula_full": "Tl1 S1",
"formula_reduced": "TlS",
"formula_anonymous": "AB",
"energy_above_hull": 0.5808733333333332,
"spacegroup": 221
},
{
"id": "jvasp-12062",
"created_at": "2022-09-04T14:37:07.092805Z",
"updated_at": "2022-09-04T14:37:07.092823Z",
"structure_string": "Tl2 S2\n1.0\n-2.027469 -3.511680 0.000000\n-4.054939 -0.000000 0.000000\n-2.027469 -1.170560 -7.167771\nTl S\n2 2\ndirect\n0.000000 0.000000 0.000000 Tl\n0.500000 0.500000 0.500000 Tl\n0.737693 0.737693 0.786921 S\n0.262307 0.262307 0.213079 S\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Tl",
"S"
],
"chemical_system": "S-Tl",
"density": 7.693640827976254,
"density_atomic": 0.03919012150983311,
"volume": 102.06653732870842,
"volume_molar": 15.366476366981914,
"formula_full": "Tl2 S2",
"formula_reduced": "TlS",
"formula_anonymous": "AB",
"energy_above_hull": 0.4742783333333332,
"spacegroup": 166
},
{
"id": "jvasp-8034",
"created_at": "2022-09-04T14:37:11.851149Z",
"updated_at": "2022-09-04T14:37:11.851177Z",
"structure_string": "Tl4 S4\n1.0\n6.282870 0.038470 -1.825795\n-3.532539 5.195874 -1.825795\n-0.020214 -0.038470 6.542750\nTl S\n4 4\ndirect\n0.250000 0.250000 0.000000 Tl\n0.749999 0.749999 0.000001 Tl\n0.750000 0.250000 0.500001 Tl\n0.250000 0.749999 0.500001 Tl\n0.675291 0.175291 0.850584 S\n0.175291 0.324709 0.500000 S\n0.824709 0.675291 0.500001 S\n0.324708 0.824708 0.149417 S\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Tl",
"S"
],
"chemical_system": "S-Tl",
"density": 7.352739932821743,
"density_atomic": 0.03745362928168859,
"volume": 213.59745780127295,
"volume_molar": 16.078924460717822,
"formula_full": "Tl4 S4",
"formula_reduced": "TlS",
"formula_anonymous": "AB",
"energy_above_hull": 0.4780983333333333,
"spacegroup": 140
},
{
"id": "jvasp-36031",
"created_at": "2022-09-04T14:37:18.877634Z",
"updated_at": "2022-09-04T14:37:18.877669Z",
"structure_string": "Tl1 Sb1\n1.0\n3.380030 3.380030 -0.000000\n3.380030 0.000000 -3.380030\n0.000000 3.380030 -3.380030\nTl Sb\n1 1\ndirect\n0.000000 0.000000 0.000000 Tl\n0.750000 0.750000 0.750000 Sb\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Tl",
"Sb"
],
"chemical_system": "Sb-Tl",
"density": 7.012387358482959,
"density_atomic": 0.02589633682557489,
"volume": 77.23100041025207,
"volume_molar": 23.254797775307782,
"formula_full": "Tl1 Sb1",
"formula_reduced": "TlSb",
"formula_anonymous": "AB",
"energy_above_hull": 0.5269864642857143,
"spacegroup": 216
},
{
"id": "jvasp-15708",
"created_at": "2022-09-04T14:36:21.679205Z",
"updated_at": "2022-09-04T14:36:21.679225Z",
"structure_string": "Tl1 Sb1\n1.0\n3.899037 -0.000000 0.000000\n-0.000000 3.899037 0.000000\n-0.000000 -0.000000 3.899037\nTl Sb\n1 1\ndirect\n0.000000 0.000000 0.000000 Tl\n0.500000 0.500000 0.500000 Sb\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Tl",
"Sb"
],
"chemical_system": "Sb-Tl",
"density": 9.136618457654754,
"density_atomic": 0.033740998169470564,
"volume": 59.27506915932423,
"volume_molar": 17.84814050180927,
"formula_full": "Tl1 Sb1",
"formula_reduced": "TlSb",
"formula_anonymous": "AB",
"energy_above_hull": 0.5104714642857143,
"spacegroup": 221
}
]
}