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=volume&page=245",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=volume&page=243",
"results": [
{
"id": "jvasp-66781",
"created_at": "2022-09-04T14:36:20.498097Z",
"updated_at": "2022-09-04T14:36:20.498125Z",
"structure_string": "Ti1 Mn1 Be2\n1.0\n-1.721518 1.721518 3.706192\n1.721518 -1.721518 3.706192\n1.721518 1.721518 -3.706192\nTi Mn Be\n1 1 2\ndirect\n0.750000 0.250000 0.500001 Ti\n0.500000 0.500000 0.000000 Mn\n0.000000 0.000000 0.000000 Be\n0.250000 0.750000 0.500001 Be\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ti",
"Mn",
"Be"
],
"chemical_system": "Be-Mn-Ti",
"density": 4.5667864850620035,
"density_atomic": 0.09104350098546975,
"volume": 43.93504156478327,
"volume_molar": 6.614575114989388,
"formula_full": "Ti1 Mn1 Be2",
"formula_reduced": "TiMnBe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.933561943678161,
"spacegroup": 119
},
{
"id": "jvasp-78566",
"created_at": "2022-09-04T14:37:10.768607Z",
"updated_at": "2022-09-04T14:37:10.768625Z",
"structure_string": "Mg1 Zr1\n1.0\n3.096222 0.000000 0.000000\n0.000000 3.096222 -0.000000\n0.000000 -0.000000 4.583807\nMg Zr\n1 1\ndirect\n0.000000 0.000000 0.000000 Mg\n0.500000 0.500000 0.500000 Zr\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Mg",
"Zr"
],
"chemical_system": "Mg-Zr",
"density": 4.365656926265105,
"density_atomic": 0.04551342178833517,
"volume": 43.94308143433391,
"volume_molar": 13.231571091285076,
"formula_full": "Mg1 Zr1",
"formula_reduced": "MgZr",
"formula_anonymous": "AB",
"energy_above_hull": 1.322864785714286,
"spacegroup": 123
},
{
"id": "jvasp-70430",
"created_at": "2022-09-04T14:36:09.133122Z",
"updated_at": "2022-09-04T14:36:09.133141Z",
"structure_string": "Li1 Be2 Ga1\n1.0\n-1.980845 1.980845 2.799824\n1.980845 -1.980845 2.799824\n1.980845 1.980845 -2.799824\nLi Be Ga\n1 2 1\ndirect\n0.749998 0.250000 0.499999 Li\n0.000000 0.000000 0.000000 Be\n0.250000 0.749998 0.499999 Be\n0.499999 0.499999 0.000000 Ga\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Li",
"Be",
"Ga"
],
"chemical_system": "Be-Ga-Li",
"density": 3.5781125728987493,
"density_atomic": 0.09102659151051981,
"volume": 43.94320311925253,
"volume_molar": 6.615803865735246,
"formula_full": "Li1 Be2 Ga1",
"formula_reduced": "LiBe2Ga",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.00609613125,
"spacegroup": 216
},
{
"id": "jvasp-73358",
"created_at": "2022-09-04T14:35:51.583972Z",
"updated_at": "2022-09-04T14:35:51.583990Z",
"structure_string": "Be2 Tc1 P1\n1.0\n3.032571 -0.000000 -0.000000\n0.000000 3.032571 -0.000000\n-0.000000 0.000000 4.779667\nBe Tc P\n2 1 1\ndirect\n0.000000 0.000000 0.031214 Be\n0.500000 0.500000 0.235919 Be\n0.500000 0.500000 0.739611 Tc\n0.000000 0.000000 0.493257 P\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Tc",
"P"
],
"chemical_system": "Be-P-Tc",
"density": 5.5531742376973146,
"density_atomic": 0.0909997912103336,
"volume": 43.956144808668256,
"volume_molar": 6.617752282618588,
"formula_full": "Be2 Tc1 P1",
"formula_reduced": "Be2TcP",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.9670673000000005,
"spacegroup": 99
},
{
"id": "jvasp-16782",
"created_at": "2022-09-04T14:38:30.014455Z",
"updated_at": "2022-09-04T14:38:30.014475Z",
"structure_string": "Sm1 Cu1\n1.0\n3.529201 -0.000000 -0.000000\n-0.000000 3.529201 -0.000000\n-0.000000 0.000000 3.529201\nSm Cu\n1 1\ndirect\n0.500000 0.500000 0.500000 Sm\n0.000000 0.000000 0.000000 Cu\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Sm",
"Cu"
],
"chemical_system": "Cu-Sm",
"density": 8.080586492509097,
"density_atomic": 0.04549889138038313,
"volume": 43.95711498285651,
"volume_molar": 13.235796691513345,
"formula_full": "Sm1 Cu1",
"formula_reduced": "SmCu",
"formula_anonymous": "AB",
"energy_above_hull": 0.3345435499999999,
"spacegroup": 221
},
{
"id": "jvasp-52175",
"created_at": "2022-09-04T14:37:27.699054Z",
"updated_at": "2022-09-04T14:37:27.699074Z",
"structure_string": "Pu1 O1 F1\n1.0\n3.961512 -0.000000 0.000000\n1.980756 3.430771 -0.000000\n1.980756 1.143590 3.234562\nPu O F\n1 1 1\ndirect\n0.000000 0.000000 0.000000 Pu\n0.250000 0.250000 0.250000 O\n0.750001 0.750000 0.750000 F\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Pu",
"O",
"F"
],
"chemical_system": "F-O-Pu",
"density": 10.538570250243975,
"density_atomic": 0.06824220773439736,
"volume": 43.96106309567496,
"volume_molar": 8.824656997379865,
"formula_full": "Pu1 O1 F1",
"formula_reduced": "PuOF",
"formula_anonymous": "ABC",
"energy_above_hull": 1.8584112608333332,
"spacegroup": 216
},
{
"id": "jvasp-21206",
"created_at": "2022-09-04T14:35:42.266172Z",
"updated_at": "2022-09-04T14:35:42.266194Z",
"structure_string": "H1\n1.0\n-2.223347 2.223347 2.223347\n2.223347 -2.223347 2.223347\n2.223347 2.223347 -2.223347\nH\n1\ndirect\n0.000000 0.000000 0.000000 H\n",
"nsites": 1,
"nelements": 1,
"elements": [
"H"
],
"chemical_system": "H",
"density": 0.03807167989875114,
"density_atomic": 0.02274669279909258,
"volume": 43.962434839753605,
"volume_molar": 26.474797075732425,
"formula_full": "H1",
"formula_reduced": "H",
"formula_anonymous": "A",
"energy_above_hull": 2.50383,
"spacegroup": 229
},
{
"id": "jvasp-891",
"created_at": "2022-09-04T14:37:47.861064Z",
"updated_at": "2022-09-04T14:37:47.861089Z",
"structure_string": "H1\n1.0\n-2.223347 2.223347 2.223347\n2.223347 -2.223347 2.223347\n2.223347 2.223347 -2.223347\nH\n1\ndirect\n0.000000 0.000000 0.000000 H\n",
"nsites": 1,
"nelements": 1,
"elements": [
"H"
],
"chemical_system": "H",
"density": 0.03807167989875114,
"density_atomic": 0.02274669279909258,
"volume": 43.962434839753605,
"volume_molar": 26.474797075732425,
"formula_full": "H1",
"formula_reduced": "H",
"formula_anonymous": "A",
"energy_above_hull": 2.50383,
"spacegroup": 229
},
{
"id": "jvasp-80099",
"created_at": "2022-09-04T14:37:15.043473Z",
"updated_at": "2022-09-04T14:37:15.043500Z",
"structure_string": "Fe3 Si1\n1.0\n-2.801282 -2.801282 0.000000\n-2.801282 0.000000 -2.801282\n0.000000 -2.801282 -2.801282\nFe Si\n3 1\ndirect\n0.000000 0.000000 0.000000 Fe\n0.749999 0.749999 0.749999 Fe\n0.500000 0.500000 0.500000 Fe\n0.250000 0.250000 0.250000 Si\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Fe",
"Si"
],
"chemical_system": "Fe-Si",
"density": 7.388613930536537,
"density_atomic": 0.09098284305860481,
"volume": 43.9643328954172,
"volume_molar": 6.618985027892518,
"formula_full": "Fe3 Si1",
"formula_reduced": "Fe3Si",
"formula_anonymous": "AB3",
"energy_above_hull": 3.286181275,
"spacegroup": 225
},
{
"id": "jvasp-20619",
"created_at": "2022-09-04T14:38:12.313153Z",
"updated_at": "2022-09-04T14:38:12.313179Z",
"structure_string": "Fe3 Si1\n1.0\n3.430944 0.000000 1.980856\n1.143648 3.234726 1.980856\n0.000000 0.000000 3.961714\nFe Si\n3 1\ndirect\n0.250000 0.250000 0.250000 Fe\n0.749999 0.750001 0.750001 Fe\n0.500000 0.500001 0.500000 Fe\n0.000000 0.000000 0.000000 Si\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Fe",
"Si"
],
"chemical_system": "Fe-Si",
"density": 7.388039573425044,
"density_atomic": 0.09097577046780148,
"volume": 43.96775074760919,
"volume_molar": 6.619499597567445,
"formula_full": "Fe3 Si1",
"formula_reduced": "Fe3Si",
"formula_anonymous": "AB3",
"energy_above_hull": 3.286178775,
"spacegroup": 225
},
{
"id": "jvasp-20430",
"created_at": "2022-09-04T14:37:38.114550Z",
"updated_at": "2022-09-04T14:37:38.114575Z",
"structure_string": "Fe3 Si1\n1.0\n3.430944 0.000000 1.980856\n1.143648 3.234726 1.980856\n0.000000 0.000000 3.961714\nFe Si\n3 1\ndirect\n0.250000 0.250000 0.250000 Fe\n0.749999 0.750001 0.750001 Fe\n0.500000 0.500001 0.500000 Fe\n0.000000 0.000000 0.000000 Si\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Fe",
"Si"
],
"chemical_system": "Fe-Si",
"density": 7.388039573425044,
"density_atomic": 0.09097577046780148,
"volume": 43.96775074760919,
"volume_molar": 6.619499597567445,
"formula_full": "Fe3 Si1",
"formula_reduced": "Fe3Si",
"formula_anonymous": "AB3",
"energy_above_hull": 3.286178775,
"spacegroup": 225
},
{
"id": "jvasp-74886",
"created_at": "2022-09-04T14:35:54.168333Z",
"updated_at": "2022-09-04T14:35:54.168354Z",
"structure_string": "Be2 Fe1 Se1\n1.0\n3.068171 0.000000 0.000000\n0.000000 3.068171 -0.000000\n-0.000000 -0.000000 4.670968\nBe Fe Se\n2 1 1\ndirect\n0.000000 0.000000 0.776409 Be\n0.000000 0.000000 0.223591 Be\n0.500000 0.500000 0.000000 Fe\n0.500000 0.500000 0.500000 Se\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Fe",
"Se"
],
"chemical_system": "Be-Fe-Se",
"density": 5.771515811902069,
"density_atomic": 0.09096911671987637,
"volume": 43.97096667781558,
"volume_molar": 6.619983767176875,
"formula_full": "Be2 Fe1 Se1",
"formula_reduced": "Be2FeSe",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.152805266666667,
"spacegroup": 123
}
]
}