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=elements&page=1103",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=elements&page=1101",
"results": [
{
"id": "jvasp-14146",
"created_at": "2022-09-04T14:37:48.479025Z",
"updated_at": "2022-09-04T14:37:48.479044Z",
"structure_string": "Zr3 Ag1\n1.0\n4.397752 0.000000 0.000000\n0.000000 4.397752 0.000000\n-0.000000 -0.000000 4.397752\nZr Ag\n3 1\ndirect\n0.500000 0.000000 0.500000 Zr\n0.500000 0.500000 0.000000 Zr\n0.000000 0.500000 0.500000 Zr\n0.000000 0.000000 0.000000 Ag\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Zr",
"Ag"
],
"chemical_system": "Ag-Zr",
"density": 7.4489866532514375,
"density_atomic": 0.047029221204731485,
"volume": 85.0535028548925,
"volume_molar": 12.805104158080612,
"formula_full": "Zr3 Ag1",
"formula_reduced": "Zr3Ag",
"formula_anonymous": "AB3",
"energy_above_hull": 3.16305519,
"spacegroup": 221
},
{
"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-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-16434",
"created_at": "2022-09-04T14:38:14.518878Z",
"updated_at": "2022-09-04T14:38:14.518901Z",
"structure_string": "Zr2 Al2\n1.0\n3.229248 -0.000000 -0.996472\n-0.000000 4.291458 -0.000000\n0.000190 0.000000 5.731332\nZr Al\n2 2\ndirect\n0.839902 0.250000 0.679804 Zr\n0.160098 0.750000 0.320196 Zr\n0.571713 0.250000 0.143426 Al\n0.428288 0.750000 0.856574 Al\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Zr",
"Al"
],
"chemical_system": "Al-Zr",
"density": 4.942545138135555,
"density_atomic": 0.05036092707214652,
"volume": 79.42665539634811,
"volume_molar": 11.957962472320549,
"formula_full": "Zr2 Al2",
"formula_reduced": "ZrAl",
"formula_anonymous": "AB",
"energy_above_hull": 1.7623086500000005,
"spacegroup": 63
},
{
"id": "jvasp-79205",
"created_at": "2022-09-04T14:36:40.916509Z",
"updated_at": "2022-09-04T14:36:40.916536Z",
"structure_string": "Zr1 Al3\n1.0\n3.972280 0.000000 -0.000000\n0.000000 3.972280 -0.000000\n-1.986141 -1.986141 4.536696\nZr Al\n1 3\ndirect\n0.000000 0.000000 0.000000 Zr\n0.500000 0.500000 0.000000 Al\n0.250000 0.750000 0.500000 Al\n0.750000 0.250000 0.500000 Al\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Zr",
"Al"
],
"chemical_system": "Al-Zr",
"density": 3.993775968799209,
"density_atomic": 0.055877968106021664,
"volume": 71.58456428498769,
"volume_molar": 10.777308059186614,
"formula_full": "Zr1 Al3",
"formula_reduced": "ZrAl3",
"formula_anonymous": "AB3",
"energy_above_hull": 2.223488225,
"spacegroup": 139
},
{
"id": "jvasp-56309",
"created_at": "2022-09-04T14:36:45.099424Z",
"updated_at": "2022-09-04T14:36:45.099459Z",
"structure_string": "Zr1 Al3\n1.0\n4.118848 -0.000000 0.000000\n0.000000 4.118848 0.000000\n-0.000000 -0.000000 4.118848\nZr Al\n1 3\ndirect\n0.000000 0.000000 0.000000 Zr\n0.000000 0.500000 0.500000 Al\n0.500000 0.000000 0.500000 Al\n0.500000 0.500000 0.000000 Al\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Zr",
"Al"
],
"chemical_system": "Al-Zr",
"density": 4.091436258091144,
"density_atomic": 0.05724435885325238,
"volume": 69.8758808750766,
"volume_molar": 10.520059758967582,
"formula_full": "Zr1 Al3",
"formula_reduced": "ZrAl3",
"formula_anonymous": "AB3",
"energy_above_hull": 2.2240807250000003,
"spacegroup": 221
},
{
"id": "jvasp-56603",
"created_at": "2022-09-04T14:38:35.192396Z",
"updated_at": "2022-09-04T14:38:35.192413Z",
"structure_string": "Zr10 Al8\n1.0\n4.240078 -7.344030 -0.000000\n4.240078 7.344030 0.000000\n-0.000000 0.000000 5.799631\nZr Al\n10 8\ndirect\n0.710483 0.000000 0.750000 Zr\n0.333333 0.666667 0.000000 Zr\n0.666667 0.333333 0.500000 Zr\n0.000000 0.289517 0.250000 Zr\n0.289517 0.000000 0.250000 Zr\n0.666667 0.333333 0.000000 Zr\n0.000000 0.710483 0.750000 Zr\n0.710483 0.710483 0.250000 Zr\n0.289517 0.289517 0.750000 Zr\n0.333333 0.666667 0.500000 Zr\n0.000000 0.000000 0.500000 Al\n0.370290 0.370290 0.250000 Al\n0.629710 0.000000 0.250000 Al\n0.000000 0.629710 0.250000 Al\n0.000000 0.000000 0.000000 Al\n0.000000 0.370290 0.750000 Al\n0.370290 0.000000 0.750000 Al\n0.629710 0.629710 0.750000 Al\n",
"nsites": 18,
"nelements": 2,
"elements": [
"Zr",
"Al"
],
"chemical_system": "Al-Zr",
"density": 5.186269602393206,
"density_atomic": 0.04983493070357674,
"volume": 361.1924356244386,
"volume_molar": 12.084176048764487,
"formula_full": "Zr10 Al8",
"formula_reduced": "Zr5Al4",
"formula_anonymous": "A4B5",
"energy_above_hull": 3.676188188888889,
"spacegroup": 193
},
{
"id": "jvasp-14692",
"created_at": "2022-09-04T14:36:59.056986Z",
"updated_at": "2022-09-04T14:36:59.057015Z",
"structure_string": "Zr2 Al6\n1.0\n3.931261 -0.000000 -0.887379\n-0.200303 3.926155 -0.887379\n0.000530 0.000558 9.154163\nZr Al\n2 6\ndirect\n0.118618 0.118618 0.237236 Zr\n0.881382 0.881381 0.762764 Zr\n0.500000 0.000000 -0.000000 Al\n0.000000 0.499999 -0.000000 Al\n0.750000 0.250000 0.500000 Al\n0.250000 0.749999 0.500000 Al\n0.374954 0.374953 0.749907 Al\n0.625047 0.625046 0.250093 Al\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Zr",
"Al"
],
"chemical_system": "Al-Zr",
"density": 4.046720011196649,
"density_atomic": 0.0566187221031412,
"volume": 141.29601839876497,
"volume_molar": 10.636306395311406,
"formula_full": "Zr2 Al6",
"formula_reduced": "ZrAl3",
"formula_anonymous": "AB3",
"energy_above_hull": 2.217123225,
"spacegroup": 139
},
{
"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-19722",
"created_at": "2022-09-04T14:38:29.107362Z",
"updated_at": "2022-09-04T14:38:29.107387Z",
"structure_string": "Zr3 Al1\n1.0\n4.381302 0.000000 -0.000000\n0.000000 4.381302 0.000000\n0.000000 -0.000000 4.381302\nZr Al\n3 1\ndirect\n0.000000 0.500000 0.500000 Zr\n0.500000 0.500000 0.000000 Zr\n0.500000 0.000000 0.500000 Zr\n0.000000 0.000000 0.000000 Al\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Zr",
"Al"
],
"chemical_system": "Al-Zr",
"density": 5.9361634113265245,
"density_atomic": 0.047560939167637636,
"volume": 84.10262854358771,
"volume_molar": 12.661946684386976,
"formula_full": "Zr3 Al1",
"formula_reduced": "Zr3Al",
"formula_anonymous": "AB3",
"energy_above_hull": 3.573474075,
"spacegroup": 221
},
{
"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-20804",
"created_at": "2022-09-04T14:38:31.992986Z",
"updated_at": "2022-09-04T14:38:31.993012Z",
"structure_string": "Zr4 Al8\n1.0\n2.653417 -4.595852 0.000000\n2.653417 4.595852 0.000000\n0.000000 -0.000000 8.793138\nZr Al\n4 8\ndirect\n0.333334 0.666668 0.564721 Zr\n0.666668 0.333334 0.064720 Zr\n0.666668 0.333334 0.435280 Zr\n0.333334 0.666668 0.935279 Zr\n0.170920 0.829081 0.250000 Al\n0.829082 0.658164 0.750000 Al\n0.341838 0.170919 0.750000 Al\n0.658164 0.829082 0.250000 Al\n0.000000 0.000000 0.000000 Al\n0.000000 0.000000 0.500000 Al\n0.829081 0.170920 0.750000 Al\n0.170919 0.341838 0.250000 Al\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Zr",
"Al"
],
"chemical_system": "Al-Zr",
"density": 4.496676291893309,
"density_atomic": 0.0559546030821836,
"volume": 214.4595679174945,
"volume_molar": 10.762547544399432,
"formula_full": "Zr4 Al8",
"formula_reduced": "ZrAl2",
"formula_anonymous": "AB2",
"energy_above_hull": 2.0964267000000003,
"spacegroup": 194
}
]
}