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=4560",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=formula_reduced&page=4558",
"results": [
{
"id": "jvasp-14612",
"created_at": "2022-09-04T14:36:47.926045Z",
"updated_at": "2022-09-04T14:36:47.926068Z",
"structure_string": "Zr2\n1.0\n1.609809 -2.788271 -0.000000\n1.609809 2.788271 0.000000\n0.000000 0.000000 5.180546\nZr\n2\ndirect\n0.333333 0.666667 0.750001 Zr\n0.666667 0.333333 0.250000 Zr\n",
"nsites": 2,
"nelements": 1,
"elements": [
"Zr"
],
"chemical_system": "Zr",
"density": 6.5143837970240535,
"density_atomic": 0.04300462181432447,
"volume": 46.506629185931295,
"volume_molar": 14.003473361540125,
"formula_full": "Zr2",
"formula_reduced": "Zr",
"formula_anonymous": "A",
"energy_above_hull": 4.500000000184912e-06,
"spacegroup": 194
},
{
"id": "jvasp-25177",
"created_at": "2022-09-04T14:37:45.889316Z",
"updated_at": "2022-09-04T14:37:45.889324Z",
"structure_string": "Zr1\n1.0\n2.910423 -0.000000 -1.028990\n-1.455211 2.520500 -1.028990\n-0.000000 -0.000000 3.086970\nZr\n1\ndirect\n0.000000 0.000000 0.000000 Zr\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Zr"
],
"chemical_system": "Zr",
"density": 6.689335592216943,
"density_atomic": 0.04415956386601084,
"volume": 22.64515118478536,
"volume_molar": 13.63722879662582,
"formula_full": "Zr1",
"formula_reduced": "Zr",
"formula_anonymous": "A",
"energy_above_hull": 0.0734345000000002,
"spacegroup": 229
},
{
"id": "jvasp-78333",
"created_at": "2022-09-04T14:36:32.762797Z",
"updated_at": "2022-09-04T14:36:32.762821Z",
"structure_string": "Zr1\n1.0\n0.000000 -1.507754 -2.611345\n0.000000 -1.507754 2.611345\n-3.009935 0.000000 0.000000\nZr\n1\ndirect\n0.000000 0.000000 0.000000 Zr\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Zr"
],
"chemical_system": "Zr",
"density": 6.391110905749253,
"density_atomic": 0.042190837389824806,
"volume": 23.701828687599612,
"volume_molar": 14.273574862613092,
"formula_full": "Zr1",
"formula_reduced": "Zr",
"formula_anonymous": "A",
"energy_above_hull": 0.3360245000000006,
"spacegroup": 191
},
{
"id": "jvasp-16081",
"created_at": "2022-09-04T14:35:55.439033Z",
"updated_at": "2022-09-04T14:35:55.439054Z",
"structure_string": "Zr1\n1.0\n2.766957 0.000000 1.597503\n0.922319 2.608713 1.597503\n0.000000 0.000000 3.195007\nZr\n1\ndirect\n0.000000 0.000000 0.000000 Zr\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Zr"
],
"chemical_system": "Zr",
"density": 6.568371111441703,
"density_atomic": 0.043361018384075654,
"volume": 23.06218897218637,
"volume_molar": 13.888374822422604,
"formula_full": "Zr1",
"formula_reduced": "Zr",
"formula_anonymous": "A",
"energy_above_hull": 0.0351945000000002,
"spacegroup": 225
},
{
"id": "jvasp-116562",
"created_at": "2022-09-04T14:38:43.605202Z",
"updated_at": "2022-09-04T14:38:43.605221Z",
"structure_string": "Zr22 Os8\n1.0\n8.252475 -0.000000 4.764569\n2.750825 7.780508 4.764569\n-0.000000 -0.000000 9.529137\nZr Os\n22 8\ndirect\n0.799590 0.799589 0.200411 Zr\n0.162836 0.162836 0.162836 Zr\n0.511495 0.162836 0.162835 Zr\n0.162836 0.511494 0.162835 Zr\n0.162836 0.162836 0.511494 Zr\n0.837165 0.837165 0.837164 Zr\n0.488506 0.837165 0.837164 Zr\n0.837165 0.488506 0.837164 Zr\n0.383145 0.383145 0.383145 Zr\n0.850567 0.383145 0.383145 Zr\n0.383146 0.850566 0.383145 Zr\n0.837165 0.837165 0.488505 Zr\n0.616856 0.616855 0.616855 Zr\n0.200412 0.799589 0.200411 Zr\n0.383145 0.383145 0.850566 Zr\n0.200411 0.200411 0.799589 Zr\n0.799589 0.200411 0.799589 Zr\n0.799589 0.200411 0.200411 Zr\n0.616856 0.616855 0.149434 Zr\n0.616855 0.149434 0.616855 Zr\n0.149434 0.616855 0.616855 Zr\n0.200412 0.799589 0.799589 Zr\n0.000000 0.500000 -0.000000 Os\n0.000000 0.000000 0.000000 Os\n0.500001 0.500000 0.500000 Os\n0.000000 0.000000 0.500000 Os\n0.500000 0.000000 0.500000 Os\n0.000000 0.500000 0.500000 Os\n0.500001 0.500000 -0.000000 Os\n0.500000 0.000000 -0.000000 Os\n",
"nsites": 30,
"nelements": 2,
"elements": [
"Zr",
"Os"
],
"chemical_system": "Os-Zr",
"density": 9.57693328750441,
"density_atomic": 0.049031537629913795,
"volume": 611.8510952366546,
"volume_molar": 12.282178065584333,
"formula_full": "Zr22 Os8",
"formula_reduced": "Zr11Os4",
"formula_anonymous": "A4B11",
"energy_above_hull": 5.882683300000001,
"spacegroup": 225
},
{
"id": "jvasp-20440",
"created_at": "2022-09-04T14:37:43.021796Z",
"updated_at": "2022-09-04T14:37:43.021822Z",
"structure_string": "Zr2 Ag1\n1.0\n3.142998 -0.000000 -0.822961\n-0.215483 3.135603 -0.822961\n0.016096 0.017240 6.474718\nZr Ag\n2 1\ndirect\n0.662592 0.662590 0.325183 Zr\n0.337410 0.337409 0.674818 Zr\n0.000000 0.000000 0.000000 Ag\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Zr",
"Ag"
],
"chemical_system": "Ag-Zr",
"density": 7.544452978289365,
"density_atomic": 0.04694924824191078,
"volume": 63.89878671841974,
"volume_molar": 12.826916267051406,
"formula_full": "Zr2 Ag1",
"formula_reduced": "Zr2Ag",
"formula_anonymous": "AB2",
"energy_above_hull": 2.429658753333334,
"spacegroup": 139
},
{
"id": "jvasp-20630",
"created_at": "2022-09-04T14:38:12.388353Z",
"updated_at": "2022-09-04T14:38:12.388369Z",
"structure_string": "Zr2 Ag1\n1.0\n3.142998 -0.000000 -0.822961\n-0.215483 3.135603 -0.822961\n0.016096 0.017240 6.474718\nZr Ag\n2 1\ndirect\n0.662592 0.662590 0.325183 Zr\n0.337410 0.337409 0.674818 Zr\n0.000000 0.000000 0.000000 Ag\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Zr",
"Ag"
],
"chemical_system": "Ag-Zr",
"density": 7.544452978289365,
"density_atomic": 0.04694924824191078,
"volume": 63.89878671841974,
"volume_molar": 12.826916267051406,
"formula_full": "Zr2 Ag1",
"formula_reduced": "Zr2Ag",
"formula_anonymous": "AB2",
"energy_above_hull": 2.429658753333334,
"spacegroup": 139
},
{
"id": "jvasp-11209",
"created_at": "2022-09-04T14:37:15.840086Z",
"updated_at": "2022-09-04T14:37:15.840105Z",
"structure_string": "Zr2 Ag1 Pd1 F11\n1.0\n5.529572 0.020986 2.076626\n1.039794 5.430970 2.076626\n0.029196 0.024230 7.902308\nZr Ag Pd F\n2 1 1 11\ndirect\n0.493000 0.493001 0.236560 Zr\n0.506999 0.506999 0.763441 Zr\n0.000000 0.000000 0.000000 Ag\n0.000000 -0.000000 0.500000 Pd\n0.804121 0.233566 0.691474 F\n0.766435 0.195880 0.308527 F\n0.195879 0.766435 0.308527 F\n0.233565 0.804121 0.691474 F\n0.500000 0.500000 0.500001 F\n0.336084 0.663915 0.000001 F\n0.663915 0.336085 0.000000 F\n0.255264 0.255264 0.343709 F\n0.744735 0.744736 0.656292 F\n0.275394 0.275394 0.892096 F\n0.724605 0.724607 0.107905 F\n",
"nsites": 15,
"nelements": 4,
"elements": [
"Zr",
"Ag",
"Pd",
"F"
],
"chemical_system": "Ag-F-Pd-Zr",
"density": 4.251365563893481,
"density_atomic": 0.06340152102562618,
"volume": 236.58738398306198,
"volume_molar": 9.498416855907792,
"formula_full": "Zr2 Ag1 Pd1 F11",
"formula_reduced": "Zr2AgPdF11",
"formula_anonymous": "ABC2D11",
"energy_above_hull": 0.4977863378333339,
"spacegroup": 12
},
{
"id": "jvasp-14957",
"created_at": "2022-09-04T14:36:46.427084Z",
"updated_at": "2022-09-04T14:36:46.427107Z",
"structure_string": "Zr4 Al2\n1.0\n2.459313 -4.259654 0.000000\n2.459313 4.259654 0.000000\n-0.000000 0.000000 5.918262\nZr Al\n4 2\ndirect\n0.000000 0.000000 0.000000 Zr\n0.000000 0.000000 0.500000 Zr\n0.333333 0.666666 0.250000 Zr\n0.666666 0.333333 0.750000 Zr\n0.333333 0.666666 0.750000 Al\n0.666666 0.333333 0.250000 Al\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Zr",
"Al"
],
"chemical_system": "Al-Zr",
"density": 5.60924896593201,
"density_atomic": 0.04838814104478079,
"volume": 123.99732394032871,
"volume_molar": 12.445488977199624,
"formula_full": "Zr4 Al2",
"formula_reduced": "Zr2Al",
"formula_anonymous": "AB2",
"energy_above_hull": 2.9298172666666678,
"spacegroup": 194
},
{
"id": "jvasp-16841",
"created_at": "2022-09-04T14:38:19.365640Z",
"updated_at": "2022-09-04T14:38:19.365659Z",
"structure_string": "Zr4 Al2\n1.0\n4.688845 0.000000 2.661022\n2.344422 4.843430 1.330510\n-0.046176 0.000000 5.542856\nZr Al\n4 2\ndirect\n0.651085 0.197827 0.500001 Zr\n0.848912 0.500000 0.802174 Zr\n0.348913 0.802173 0.500001 Zr\n0.151086 0.500000 0.197827 Zr\n0.749999 -0.000000 0.000000 Al\n0.250000 -0.000000 0.000000 Al\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Zr",
"Al"
],
"chemical_system": "Al-Zr",
"density": 5.499409770787239,
"density_atomic": 0.04744061411217525,
"volume": 126.4739108522659,
"volume_molar": 12.694061560333948,
"formula_full": "Zr4 Al2",
"formula_reduced": "Zr2Al",
"formula_anonymous": "AB2",
"energy_above_hull": 2.9449472666666674,
"spacegroup": 140
},
{
"id": "jvasp-20157",
"created_at": "2022-09-04T14:38:15.085858Z",
"updated_at": "2022-09-04T14:38:15.085874Z",
"structure_string": "Zr4 Al6\n1.0\n5.482302 -0.001411 -1.041969\n-3.015950 4.578174 -1.041969\n0.002028 0.003764 7.537868\nZr Al\n4 6\ndirect\n0.864767 0.730003 0.605585 Zr\n0.124419 0.259181 0.394414 Zr\n0.980004 0.614767 0.105585 Zr\n0.509181 0.874417 0.894414 Zr\n0.129228 0.129228 -0.000000 Al\n0.379227 0.879227 0.500000 Al\n0.456482 0.320020 0.769918 Al\n0.550103 0.686564 0.230082 Al\n0.570021 0.206482 0.269918 Al\n0.936565 0.300102 0.730082 Al\n",
"nsites": 10,
"nelements": 2,
"elements": [
"Zr",
"Al"
],
"chemical_system": "Al-Zr",
"density": 4.623318594502082,
"density_atomic": 0.052853181323009944,
"volume": 189.20336959255926,
"volume_molar": 11.394093239526958,
"formula_full": "Zr4 Al6",
"formula_reduced": "Zr2Al3",
"formula_anonymous": "A2B3",
"energy_above_hull": 2.81127948,
"spacegroup": 43
},
{
"id": "jvasp-86055",
"created_at": "2022-09-04T14:36:05.074834Z",
"updated_at": "2022-09-04T14:36:05.074862Z",
"structure_string": "Zr4 Al6 C8\n1.0\n3.360923 -0.000000 0.000000\n-1.680461 2.910644 -0.000000\n-0.000000 -0.000000 22.350893\nZr Al C\n4 6 8\ndirect\n0.333332 0.666666 0.058477 Zr\n0.666666 0.333332 0.941523 Zr\n0.333332 0.666666 0.441523 Zr\n0.666666 0.333332 0.558477 Zr\n0.333332 0.666666 0.750000 Al\n0.666666 0.333332 0.250000 Al\n0.000000 0.000000 0.159274 Al\n0.000000 0.000000 0.840726 Al\n0.000000 0.000000 0.340726 Al\n0.000000 0.000000 0.659274 Al\n0.000000 0.000000 0.500000 C\n0.666666 0.333332 0.371531 C\n0.333332 0.666666 0.628469 C\n0.333332 0.666666 0.871530 C\n0.000000 0.000000 0.000000 C\n0.666666 0.333332 0.128469 C\n0.000000 0.000000 0.250000 C\n0.000000 0.000000 0.750000 C\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Zr",
"Al",
"C"
],
"chemical_system": "Al-C-Zr",
"density": 4.7304728995136625,
"density_atomic": 0.0823246650963361,
"volume": 218.6465013727836,
"volume_molar": 7.31511115526909,
"formula_full": "Zr4 Al6 C8",
"formula_reduced": "Zr2Al3C4",
"formula_anonymous": "A2B3C4",
"energy_above_hull": 4.9050886,
"spacegroup": 194
}
]
}