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=-id&page=4125",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-id&page=4123",
"results": [
{
"id": "jvasp-109106",
"created_at": "2022-09-04T14:38:02.718769Z",
"updated_at": "2022-09-04T14:38:02.718796Z",
"structure_string": "La2 Si2 Pt2\n1.0\n4.118033 -0.000702 -6.789515\n-0.322444 4.105390 -6.789515\n0.000649 0.000702 7.940763\nLa Si Pt\n2 2 2\ndirect\n0.580339 0.580339 -0.000000 La\n0.330340 0.830339 0.500000 La\n0.999498 0.999499 -0.000000 Si\n0.749498 0.249498 0.499999 Si\n0.167163 0.167163 -0.000000 Pt\n0.917163 0.417163 0.499999 Pt\n",
"nsites": 6,
"nelements": 3,
"elements": [
"La",
"Si",
"Pt"
],
"chemical_system": "La-Pt-Si",
"density": 8.954677559924363,
"density_atomic": 0.044681074263360675,
"volume": 134.28504347578126,
"volume_molar": 13.478057229564573,
"formula_full": "La2 Si2 Pt2",
"formula_reduced": "LaSiPt",
"formula_anonymous": "ABC",
"energy_above_hull": 1.863071666666667,
"spacegroup": 109
},
{
"id": "jvasp-109105",
"created_at": "2022-09-04T14:37:59.526633Z",
"updated_at": "2022-09-04T14:37:59.526655Z",
"structure_string": "Pb4 I2 O2 F2\n1.0\n7.395029 0.029253 0.000000\n-5.011032 5.438462 0.000000\n0.000000 -0.000000 5.975863\nPb I O F\n4 2 2 2\ndirect\n0.406594 0.593406 0.220583 Pb\n0.593406 0.406593 0.779416 Pb\n0.093406 0.906593 0.220583 Pb\n0.906594 0.093406 0.779416 Pb\n0.750000 0.249999 0.244651 I\n0.250000 0.750000 0.755348 I\n0.250000 0.250000 -0.000000 O\n0.750000 0.749999 -0.000000 O\n0.250000 0.250000 0.500000 F\n0.750000 0.749999 0.500000 F\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Pb",
"I",
"O",
"F"
],
"chemical_system": "F-I-O-Pb",
"density": 7.9347408279132665,
"density_atomic": 0.041457520123075055,
"volume": 241.2107615292225,
"volume_molar": 14.526051587557708,
"formula_full": "Pb4 I2 O2 F2",
"formula_reduced": "Pb2IOF",
"formula_anonymous": "ABCD2",
"energy_above_hull": 0.2094523394999997,
"spacegroup": 67
},
{
"id": "jvasp-109104",
"created_at": "2022-09-04T14:38:14.127966Z",
"updated_at": "2022-09-04T14:38:14.127993Z",
"structure_string": "Rb2 Li1 V1 Cl6\n1.0\n6.932586 -0.000000 0.000000\n-3.466293 6.003796 0.000000\n-0.000000 -0.000000 5.932204\nRb Li V Cl\n2 1 1 6\ndirect\n0.333334 0.666667 0.251603 Rb\n0.666667 0.333334 0.748397 Rb\n0.000000 0.000000 0.000000 Li\n0.000000 0.000000 0.500000 V\n0.838278 0.161723 0.264347 Cl\n0.161724 0.838278 0.735653 Cl\n0.838278 0.676554 0.264347 Cl\n0.161723 0.323446 0.735653 Cl\n0.323446 0.161723 0.264347 Cl\n0.676555 0.838278 0.735653 Cl\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Rb",
"Li",
"V",
"Cl"
],
"chemical_system": "Cl-Li-Rb-V",
"density": 2.969463862745136,
"density_atomic": 0.04050071867139368,
"volume": 246.90919884992468,
"volume_molar": 14.869219504130765,
"formula_full": "Rb2 Li1 V1 Cl6",
"formula_reduced": "Rb2LiVCl6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.2710448605000001,
"spacegroup": 164
},
{
"id": "jvasp-109103",
"created_at": "2022-09-04T14:38:14.079630Z",
"updated_at": "2022-09-04T14:38:14.079655Z",
"structure_string": "V2 Co2 O6\n1.0\n4.280924 -0.026471 -2.368017\n-1.415102 4.687486 2.445568\n-0.090948 -0.026346 4.890502\nV Co O\n2 2 6\ndirect\n0.650181 0.950470 0.349869 V\n0.349822 0.049533 0.650133 V\n0.152655 0.457885 0.847346 Co\n0.847345 0.542113 0.152654 Co\n0.432121 0.237305 0.265842 O\n0.567879 0.762692 0.734158 O\n0.928799 0.762611 0.432116 O\n0.071200 0.237391 0.567882 O\n0.734160 0.237409 0.928908 O\n0.265832 0.762590 0.071088 O\n",
"nsites": 10,
"nelements": 3,
"elements": [
"V",
"Co",
"O"
],
"chemical_system": "Co-O-V",
"density": 5.397599788431471,
"density_atomic": 0.1029470755677015,
"volume": 97.1372906404093,
"volume_molar": 5.849744372815754,
"formula_full": "V2 Co2 O6",
"formula_reduced": "VCoO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 2.78518312,
"spacegroup": 148
},
{
"id": "jvasp-109102",
"created_at": "2022-09-04T14:37:50.939112Z",
"updated_at": "2022-09-04T14:37:50.939137Z",
"structure_string": "Li2 Sn1 F6\n1.0\n4.962890 -0.000000 0.000000\n-2.481445 4.297989 0.000000\n-0.000000 -0.000000 4.587861\nLi Sn F\n2 1 6\ndirect\n0.666667 0.333333 0.500000 Li\n0.333334 0.666667 0.500000 Li\n0.000000 0.000000 0.000000 Sn\n0.329206 0.329206 0.254326 F\n0.670795 0.670795 0.745674 F\n0.670795 0.000000 0.254326 F\n0.329205 0.000000 0.745674 F\n0.000001 0.670795 0.254326 F\n0.000000 0.329206 0.745674 F\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Li",
"Sn",
"F"
],
"chemical_system": "F-Li-Sn",
"density": 4.18408988833274,
"density_atomic": 0.09196706121806938,
"volume": 97.86112419814617,
"volume_molar": 6.548149609478648,
"formula_full": "Li2 Sn1 F6",
"formula_reduced": "Li2SnF6",
"formula_anonymous": "AB2C6",
"energy_above_hull": 0.0,
"spacegroup": 162
},
{
"id": "jvasp-109101",
"created_at": "2022-09-04T14:37:50.884005Z",
"updated_at": "2022-09-04T14:37:50.884027Z",
"structure_string": "Ho2 Mn4 Si2 C2\n1.0\n5.578188 0.000934 0.000000\n-4.360960 3.478248 0.000000\n-0.000000 -0.000000 6.952551\nHo Mn Si C\n2 4 2 2\ndirect\n0.543592 0.456408 0.250000 Ho\n0.456408 0.543592 0.750000 Ho\n0.831620 0.168379 0.061560 Mn\n0.168380 0.831621 0.938440 Mn\n0.168380 0.831621 0.561559 Mn\n0.831620 0.168379 0.438440 Mn\n0.264698 0.735302 0.250000 Si\n0.735302 0.264697 0.750000 Si\n0.000000 0.000000 0.000000 C\n0.000000 0.000000 0.500000 C\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Ho",
"Mn",
"Si",
"C"
],
"chemical_system": "C-Ho-Mn-Si",
"density": 7.7511531310357125,
"density_atomic": 0.07411582778488701,
"volume": 134.9239467313769,
"volume_molar": 8.125309991110937,
"formula_full": "Ho2 Mn4 Si2 C2",
"formula_reduced": "HoMn2SiC",
"formula_anonymous": "ABCD2",
"energy_above_hull": 3.9479497298850577,
"spacegroup": 63
},
{
"id": "jvasp-109100",
"created_at": "2022-09-04T14:38:16.069891Z",
"updated_at": "2022-09-04T14:38:16.069917Z",
"structure_string": "La4 Ru4 I2\n1.0\n4.332507 -0.000000 0.000000\n-2.166253 3.752061 0.000000\n-0.000000 -0.000000 17.791918\nLa Ru I\n4 4 2\ndirect\n0.000000 0.000000 0.106133 La\n0.000000 0.000000 0.893867 La\n0.000000 0.000000 0.606133 La\n0.000000 0.000000 0.393867 La\n0.333334 0.666666 0.502954 Ru\n0.666667 0.333333 0.497047 Ru\n0.666667 0.333333 0.002953 Ru\n0.333334 0.666666 0.997047 Ru\n0.333334 0.666666 0.250000 I\n0.666667 0.333333 0.750000 I\n",
"nsites": 10,
"nelements": 3,
"elements": [
"La",
"Ru",
"I"
],
"chemical_system": "I-La-Ru",
"density": 6.968389044228208,
"density_atomic": 0.03457546807507756,
"volume": 289.2224041128203,
"volume_molar": 17.41738028513007,
"formula_full": "La4 Ru4 I2",
"formula_reduced": "La2Ru2I",
"formula_anonymous": "AB2C2",
"energy_above_hull": 2.5125894550000005,
"spacegroup": 194
},
{
"id": "jvasp-1091",
"created_at": "2022-09-04T14:37:13.348367Z",
"updated_at": "2022-09-04T14:37:13.348387Z",
"structure_string": "Zr1 Ni1 Sn1\n1.0\n3.761489 0.000000 2.171697\n1.253829 3.546367 2.171697\n0.000000 0.000000 4.343394\nZr Ni Sn\n1 1 1\ndirect\n0.000000 0.000000 0.000000 Zr\n0.250000 0.250000 0.250000 Ni\n0.500000 0.500000 0.500000 Sn\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Zr",
"Ni",
"Sn"
],
"chemical_system": "Ni-Sn-Zr",
"density": 7.698865026949293,
"density_atomic": 0.05177839144542083,
"volume": 57.939227470252234,
"volume_molar": 11.630606111717254,
"formula_full": "Zr1 Ni1 Sn1",
"formula_reduced": "ZrNiSn",
"formula_anonymous": "ABC",
"energy_above_hull": 1.4685895333333336,
"spacegroup": 216
},
{
"id": "jvasp-109099",
"created_at": "2022-09-04T14:37:50.844246Z",
"updated_at": "2022-09-04T14:37:50.844271Z",
"structure_string": "Ba2 Pr1 Ta1 O6\n1.0\n5.327863 -0.000000 3.076043\n1.775954 5.023157 3.076043\n-0.000000 -0.000000 6.152086\nBa Pr Ta O\n2 1 1 6\ndirect\n0.250000 0.250000 0.250000 Ba\n0.749999 0.750000 0.750000 Ba\n0.499999 0.500000 0.500000 Pr\n0.000000 0.000000 0.000000 Ta\n0.769480 0.230519 0.230519 O\n0.230518 0.769481 0.769481 O\n0.230518 0.769481 0.230519 O\n0.769480 0.230519 0.769481 O\n0.230519 0.230519 0.769481 O\n0.769480 0.769481 0.230519 O\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Ba",
"Pr",
"Ta",
"O"
],
"chemical_system": "Ba-O-Pr-Ta",
"density": 6.984259947486129,
"density_atomic": 0.060736225786148554,
"volume": 164.64638476565645,
"volume_molar": 9.91523704683903,
"formula_full": "Ba2 Pr1 Ta1 O6",
"formula_reduced": "Ba2PrTaO6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 2.349323199,
"spacegroup": 225
},
{
"id": "jvasp-109098",
"created_at": "2022-09-04T14:37:50.613304Z",
"updated_at": "2022-09-04T14:37:50.613323Z",
"structure_string": "U2 Si2 Os4 C2\n1.0\n6.022476 -0.005150 0.000000\n-4.784291 3.657978 0.000000\n0.000000 0.000000 6.982984\nU Si Os C\n2 2 4 2\ndirect\n0.553680 0.446321 0.250000 U\n0.446322 0.553679 0.750000 U\n0.274659 0.725342 0.250000 Si\n0.725342 0.274659 0.750000 Si\n0.835923 0.164078 0.051638 Os\n0.164078 0.835923 0.948361 Os\n0.164078 0.835923 0.551638 Os\n0.835923 0.164078 0.448362 Os\n0.000000 0.000000 0.000000 C\n0.000000 0.000000 0.500000 C\n",
"nsites": 10,
"nelements": 4,
"elements": [
"U",
"Si",
"Os",
"C"
],
"chemical_system": "C-Os-Si-U",
"density": 14.233764829417366,
"density_atomic": 0.06507718901897963,
"volume": 153.66367464156326,
"volume_molar": 9.253842783903366,
"formula_full": "U2 Si2 Os4 C2",
"formula_reduced": "USiOs2C",
"formula_anonymous": "ABCD2",
"energy_above_hull": 5.704822920000002,
"spacegroup": 63
},
{
"id": "jvasp-109097",
"created_at": "2022-09-04T14:38:17.590967Z",
"updated_at": "2022-09-04T14:38:17.590991Z",
"structure_string": "Sm2 Si2 Os4 C2\n1.0\n5.916563 -0.004705 0.000000\n-4.604300 3.715664 0.000000\n0.000000 -0.000000 7.176065\nSm Si Os C\n2 2 4 2\ndirect\n0.548555 0.451443 0.250000 Sm\n0.451443 0.548555 0.749999 Sm\n0.270120 0.729877 0.250000 Si\n0.729877 0.270120 0.749999 Si\n0.834348 0.165649 0.058289 Os\n0.165649 0.834348 0.941710 Os\n0.165649 0.834348 0.558289 Os\n0.834348 0.165649 0.441710 Os\n0.000000 0.000000 0.000000 C\n0.000000 0.000000 0.500000 C\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Sm",
"Si",
"Os",
"C"
],
"chemical_system": "C-Os-Si-Sm",
"density": 12.030601381077412,
"density_atomic": 0.0634506210975759,
"volume": 157.60287018501768,
"volume_molar": 9.491066684341837,
"formula_full": "Sm2 Si2 Os4 C2",
"formula_reduced": "SmSiOs2C",
"formula_anonymous": "ABCD2",
"energy_above_hull": 4.7164974950000005,
"spacegroup": 63
},
{
"id": "jvasp-109096",
"created_at": "2022-09-04T14:38:46.204337Z",
"updated_at": "2022-09-04T14:38:46.204361Z",
"structure_string": "Zn6 In2\n1.0\n7.219524 0.011275 0.000000\n-5.271985 4.932325 0.000000\n-0.000000 0.000000 4.242928\nZn In\n6 2\ndirect\n0.877224 0.122777 0.750000 Zn\n0.324158 0.195379 0.750000 Zn\n0.804621 0.675842 0.750000 Zn\n0.122777 0.877223 0.250000 Zn\n0.675842 0.804621 0.250000 Zn\n0.195379 0.324158 0.250000 Zn\n0.708637 0.291364 0.250000 In\n0.291363 0.708636 0.750000 In\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Zn",
"In"
],
"chemical_system": "In-Zn",
"density": 6.825776265586439,
"density_atomic": 0.05286152869434836,
"volume": 151.33879396974973,
"volume_molar": 11.3922939966809,
"formula_full": "Zn6 In2",
"formula_reduced": "Zn3In",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 63
}
]
}