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=4012",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=id&page=4010",
"results": [
{
"id": "jvasp-8187",
"created_at": "2022-09-04T14:37:17.618677Z",
"updated_at": "2022-09-04T14:37:17.618702Z",
"structure_string": "Ta1 Cu1 N2\n1.0\n3.051404 0.001740 5.323165\n1.418849 2.701470 5.323165\n0.002876 0.001740 6.135727\nTa Cu N\n1 1 2\ndirect\n0.500000 0.500000 0.499999 Ta\n0.000000 0.000000 0.000000 Cu\n0.893988 0.893988 0.893987 N\n0.106012 0.106012 0.106012 N\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ta",
"Cu",
"N"
],
"chemical_system": "Cu-N-Ta",
"density": 8.959351048855597,
"density_atomic": 0.07919711084871942,
"volume": 50.50689295523308,
"volume_molar": 7.603990468166649,
"formula_full": "Ta1 Cu1 N2",
"formula_reduced": "TaCuN2",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.9738665374999993,
"spacegroup": 166
},
{
"id": "jvasp-81878",
"created_at": "2022-09-04T14:37:12.580649Z",
"updated_at": "2022-09-04T14:37:12.580692Z",
"structure_string": "Ag1 Pd2 Pb1\n1.0\n-9.399844 0.000000 -5.427002\n-6.021139 -1.128547 -0.425087\n-4.608325 2.867493 -2.872152\nAg Pd Pb\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Ag\n0.751416 0.000000 -0.000000 Pd\n0.248584 0.000000 -0.000000 Pd\n0.500000 0.000000 -0.000000 Pb\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ag",
"Pd",
"Pb"
],
"chemical_system": "Ag-Pb-Pd",
"density": 10.957854911931978,
"density_atomic": 0.05000092419865152,
"volume": 79.99852130948965,
"volume_molar": 12.044058897940156,
"formula_full": "Ag1 Pd2 Pb1",
"formula_reduced": "AgPd2Pb",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.8753623700000001,
"spacegroup": 71
},
{
"id": "jvasp-8188",
"created_at": "2022-09-04T14:37:05.131263Z",
"updated_at": "2022-09-04T14:37:05.131276Z",
"structure_string": "Si6 Mo3\n1.0\n2.323271 -4.024023 0.000000\n2.323271 4.024023 -0.000000\n-0.000000 -0.000000 6.638423\nSi Mo\n6 3\ndirect\n0.164147 0.835853 0.833333 Si\n0.328295 0.164147 0.166667 Si\n0.835853 0.671705 0.500000 Si\n0.835853 0.164147 0.833333 Si\n0.671705 0.835853 0.166667 Si\n0.164147 0.328295 0.500000 Si\n0.500000 0.000000 0.500000 Mo\n0.000000 0.500000 0.166667 Mo\n0.500000 0.500000 0.833333 Mo\n",
"nsites": 9,
"nelements": 2,
"elements": [
"Si",
"Mo"
],
"chemical_system": "Mo-Si",
"density": 6.104860296984659,
"density_atomic": 0.0725082236812893,
"volume": 124.1238516552219,
"volume_molar": 8.305458959345614,
"formula_full": "Si6 Mo3",
"formula_reduced": "Si2Mo",
"formula_anonymous": "AB2",
"energy_above_hull": 3.5213776999999995,
"spacegroup": 180
},
{
"id": "jvasp-81881",
"created_at": "2022-09-04T14:37:18.223868Z",
"updated_at": "2022-09-04T14:37:18.223898Z",
"structure_string": "Al1 Tc2 Sb1\n1.0\n-9.509425 0.000002 -5.490268\n-6.050551 -0.444119 -0.500676\n-4.977298 2.591497 -2.359604\nAl Tc Sb\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Al\n0.748877 0.000000 -0.000000 Tc\n0.251124 0.000000 -0.000000 Tc\n0.500000 0.000000 -0.000000 Sb\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Al",
"Tc",
"Sb"
],
"chemical_system": "Al-Sb-Tc",
"density": 7.54028664913122,
"density_atomic": 0.052687201863650564,
"volume": 75.91976530375663,
"volume_molar": 11.429987828134665,
"formula_full": "Al1 Tc2 Sb1",
"formula_reduced": "AlTc2Sb",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.738740475,
"spacegroup": 139
},
{
"id": "jvasp-81882",
"created_at": "2022-09-04T14:37:04.014249Z",
"updated_at": "2022-09-04T14:37:04.014277Z",
"structure_string": "Be1 Ga1 Pd2\n1.0\n-9.996206 1.838238 -0.649697\n-7.609581 0.178702 1.750830\n-5.913401 3.565806 -0.543992\nBe Ga Pd\n1 1 2\ndirect\n-0.000049 0.000026 0.000049 Be\n0.500012 -0.000007 -0.000011 Ga\n0.719324 0.062565 -0.000925 Pd\n0.280717 0.937414 0.000885 Pd\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Ga",
"Pd"
],
"chemical_system": "Be-Ga-Pd",
"density": 9.019536989341606,
"density_atomic": 0.07451515041305888,
"volume": 53.68035866299472,
"volume_molar": 8.08176689789599,
"formula_full": "Be1 Ga1 Pd2",
"formula_reduced": "BeGaPd2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.05781245625,
"spacegroup": 71
},
{
"id": "jvasp-81889",
"created_at": "2022-09-04T14:36:49.605720Z",
"updated_at": "2022-09-04T14:36:49.605743Z",
"structure_string": "Zr1 Be1 Rh2\n1.0\n-8.390083 -0.000001 -4.844018\n-5.499019 0.120478 -0.163454\n-4.686495 2.418644 -1.570788\nZr Be Rh\n1 1 2\ndirect\n0.500000 -0.000001 0.000000 Zr\n0.000000 0.000000 0.000000 Be\n0.792243 -0.000001 0.000000 Rh\n0.207757 -0.000000 0.000000 Rh\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Zr",
"Be",
"Rh"
],
"chemical_system": "Be-Rh-Zr",
"density": 8.475406656339528,
"density_atomic": 0.06670878858195917,
"volume": 59.96211421356506,
"volume_molar": 9.027507301532138,
"formula_full": "Zr1 Be1 Rh2",
"formula_reduced": "ZrBeRh2",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.94320665,
"spacegroup": 71
},
{
"id": "jvasp-8189",
"created_at": "2022-09-04T14:37:04.941730Z",
"updated_at": "2022-09-04T14:37:04.941740Z",
"structure_string": "Si6 W3\n1.0\n2.322404 -4.022523 -0.000000\n2.322404 4.022523 -0.000000\n-0.000000 0.000000 6.671152\nSi W\n6 3\ndirect\n0.163834 0.327669 0.000000 Si\n0.327669 0.163834 0.666667 Si\n0.836165 0.163834 0.333333 Si\n0.836164 0.672329 0.000000 Si\n0.672329 0.836164 0.666667 Si\n0.163834 0.836165 0.333333 Si\n0.499999 0.499999 0.333333 W\n-0.000000 0.499999 0.666667 W\n0.499999 -0.000000 0.000000 W\n",
"nsites": 9,
"nelements": 2,
"elements": [
"Si",
"W"
],
"chemical_system": "Si-W",
"density": 9.592556372567888,
"density_atomic": 0.072206346472206,
"volume": 124.64278335235147,
"volume_molar": 8.340182067400502,
"formula_full": "Si6 W3",
"formula_reduced": "Si2W",
"formula_anonymous": "AB2",
"energy_above_hull": 4.209195733333333,
"spacegroup": 180
},
{
"id": "jvasp-81890",
"created_at": "2022-09-04T14:36:49.792297Z",
"updated_at": "2022-09-04T14:36:49.792318Z",
"structure_string": "Be2 Zn1 Pt1\n1.0\n-8.972902 0.000000 -5.180508\n-5.643039 -0.984773 -0.586985\n-4.407754 2.509141 -2.726561\nBe Zn Pt\n2 1 1\ndirect\n0.722632 -0.000001 -0.000000 Be\n0.277369 -0.000000 -0.000000 Be\n0.000000 0.000000 0.000000 Zn\n0.500000 -0.000001 -0.000000 Pt\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Zn",
"Pt"
],
"chemical_system": "Be-Pt-Zn",
"density": 7.901704642693361,
"density_atomic": 0.06834069795187253,
"volume": 58.53027727075474,
"volume_molar": 8.811939211157842,
"formula_full": "Be2 Zn1 Pt1",
"formula_reduced": "Be2ZnPt",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.2437735,
"spacegroup": 71
},
{
"id": "jvasp-819",
"created_at": "2022-09-04T14:37:45.938338Z",
"updated_at": "2022-09-04T14:37:45.938363Z",
"structure_string": "Ar1\n1.0\n3.193591 -0.000000 1.843821\n1.064531 3.010947 1.843821\n-0.000000 0.000000 3.687642\nAr\n1\ndirect\n0.000000 0.000000 0.000000 Ar\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Ar"
],
"chemical_system": "Ar",
"density": 1.870738048485067,
"density_atomic": 0.02820128130809556,
"volume": 35.45938175911661,
"volume_molar": 21.35413882159766,
"formula_full": "Ar1",
"formula_reduced": "Ar",
"formula_anonymous": "A",
"energy_above_hull": 4.39999999990448e-06,
"spacegroup": 225
},
{
"id": "jvasp-8190",
"created_at": "2022-09-04T14:37:04.062644Z",
"updated_at": "2022-09-04T14:37:04.062671Z",
"structure_string": "Cu2 W1 S4\n1.0\n5.438402 0.000000 0.000000\n0.000000 5.438402 0.000000\n0.000000 0.000000 5.204994\nCu W S\n2 1 4\ndirect\n0.000000 0.500000 0.000000 Cu\n0.500000 0.000000 0.000000 Cu\n0.000000 0.000000 0.000000 W\n0.237696 0.762303 0.251767 S\n0.762303 0.762303 0.748232 S\n0.237696 0.237696 0.748232 S\n0.762303 0.237696 0.251767 S\n",
"nsites": 7,
"nelements": 3,
"elements": [
"Cu",
"W",
"S"
],
"chemical_system": "Cu-S-W",
"density": 4.737406712409885,
"density_atomic": 0.0454710719879966,
"volume": 153.94402845501094,
"volume_molar": 13.24389440739316,
"formula_full": "Cu2 W1 S4",
"formula_reduced": "Cu2WS4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 2.3238401285714283,
"spacegroup": 111
},
{
"id": "jvasp-81907",
"created_at": "2022-09-04T14:37:16.512402Z",
"updated_at": "2022-09-04T14:37:16.512427Z",
"structure_string": "Li2 Tl1 Sb1\n1.0\n-11.623500 3.694181 -0.677378\n-8.316495 1.135099 2.040620\n-6.876481 5.208226 -0.454385\nLi Tl Sb\n2 1 1\ndirect\n0.750043 0.000040 0.000003 Li\n0.249959 -0.000041 -0.000004 Li\n0.500002 -0.000001 -0.000001 Tl\n-0.000001 0.000001 0.000001 Sb\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Li",
"Tl",
"Sb"
],
"chemical_system": "Li-Sb-Tl",
"density": 6.431921298918867,
"density_atomic": 0.04556594516080664,
"volume": 87.78485743867732,
"volume_molar": 13.216319202306197,
"formula_full": "Li2 Tl1 Sb1",
"formula_reduced": "Li2TlSb",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.477777175,
"spacegroup": 225
},
{
"id": "jvasp-81908",
"created_at": "2022-09-04T14:37:15.283624Z",
"updated_at": "2022-09-04T14:37:15.283655Z",
"structure_string": "Cd1 Cu1 Pd2\n1.0\n-8.648752 -0.000000 -4.993359\n-9.112500 -0.002439 5.796594\n-5.919267 9.029384 0.265754\nCd Cu Pd\n1 1 2\ndirect\n0.500000 -0.000000 -0.000000 Cd\n0.000000 0.000000 0.000000 Cu\n0.763842 -0.000000 -0.000000 Pd\n0.236158 -0.000000 -0.000000 Pd\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Cd",
"Cu",
"Pd"
],
"chemical_system": "Cd-Cu-Pd",
"density": 0.7475782140385036,
"density_atomic": 0.00463174482890051,
"volume": 863.6054333220956,
"volume_molar": 130.01883701416136,
"formula_full": "Cd1 Cu1 Pd2",
"formula_reduced": "CdCuPd2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.7406204000000001,
"spacegroup": 71
}
]
}