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{
"count": 55712,
"next": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-chemical_system&page=3559",
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"results": [
{
"id": "jvasp-74874",
"created_at": "2022-09-04T14:36:20.926330Z",
"updated_at": "2022-09-04T14:36:20.926354Z",
"structure_string": "Mn1 Be2 Cd1\n1.0\n2.759191 0.000000 0.000000\n0.000000 2.759191 0.000000\n-0.000000 0.000000 6.474669\nMn Be Cd\n1 2 1\ndirect\n0.500000 0.500000 0.811734 Mn\n0.000000 0.000000 0.019021 Be\n0.500000 0.500000 0.187210 Be\n0.000000 0.000000 0.482035 Cd\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Mn",
"Be",
"Cd"
],
"chemical_system": "Be-Cd-Mn",
"density": 6.244755416745485,
"density_atomic": 0.08114819994362811,
"volume": 49.29252901208792,
"volume_molar": 7.421163703179429,
"formula_full": "Mn1 Be2 Cd1",
"formula_reduced": "MnBe2Cd",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.6299559015086214,
"spacegroup": 99
},
{
"id": "jvasp-69839",
"created_at": "2022-09-04T14:35:49.331126Z",
"updated_at": "2022-09-04T14:35:49.331154Z",
"structure_string": "Mg2 Be1 Cd2\n1.0\n-1.955265 1.955265 7.531786\n1.955265 -1.955265 7.531786\n1.955265 1.955265 -7.531786\nMg Be Cd\n2 1 2\ndirect\n0.592676 0.592676 0.000000 Mg\n0.407324 0.407324 0.000000 Mg\n0.000000 0.000000 0.000000 Be\n0.750001 0.250000 0.500001 Cd\n0.250000 0.750001 0.500001 Cd\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Mg",
"Be",
"Cd"
],
"chemical_system": "Be-Cd-Mg",
"density": 4.0720444945519345,
"density_atomic": 0.04341109978262754,
"volume": 115.1779159025343,
"volume_molar": 13.872352440170081,
"formula_full": "Mg2 Be1 Cd2",
"formula_reduced": "Mg2BeCd2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 0.0,
"spacegroup": 139
},
{
"id": "jvasp-66759",
"created_at": "2022-09-04T14:36:12.099005Z",
"updated_at": "2022-09-04T14:36:12.099016Z",
"structure_string": "Li1 Be1 Cd1\n1.0\n-1.565096 1.565096 4.334233\n1.565096 -1.565096 4.334233\n1.565096 1.565096 -4.334233\nLi Be Cd\n1 1 1\ndirect\n0.653938 0.653938 0.000000 Li\n0.008168 0.008168 0.000000 Be\n0.337893 0.337893 0.000000 Cd\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Li",
"Be",
"Cd"
],
"chemical_system": "Be-Cd-Li",
"density": 5.019249059863525,
"density_atomic": 0.07064266032975186,
"volume": 42.46725683880453,
"volume_molar": 8.524793279145118,
"formula_full": "Li1 Be1 Cd1",
"formula_reduced": "LiBeCd",
"formula_anonymous": "ABC",
"energy_above_hull": 0.2286652833333331,
"spacegroup": 107
},
{
"id": "jvasp-71966",
"created_at": "2022-09-04T14:36:20.617614Z",
"updated_at": "2022-09-04T14:36:20.617639Z",
"structure_string": "Li1 Be1 Cd1\n1.0\n1.421857 -2.462728 0.000000\n1.421857 2.462728 -0.000000\n-0.000000 -0.000000 6.714227\nLi Be Cd\n1 1 1\ndirect\n0.333334 0.666668 0.687408 Li\n0.000000 0.000000 0.991616 Be\n0.666668 0.333334 0.320977 Cd\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Li",
"Be",
"Cd"
],
"chemical_system": "Be-Cd-Li",
"density": 4.533092391281135,
"density_atomic": 0.06380032196476876,
"volume": 47.021706280050324,
"volume_molar": 9.4390444664613,
"formula_full": "Li1 Be1 Cd1",
"formula_reduced": "LiBeCd",
"formula_anonymous": "ABC",
"energy_above_hull": 0.2870052833333331,
"spacegroup": 156
},
{
"id": "jvasp-67632",
"created_at": "2022-09-04T14:35:41.088767Z",
"updated_at": "2022-09-04T14:35:41.088795Z",
"structure_string": "Li2 Be1 Cd1\n1.0\n-2.164892 2.164892 3.064315\n2.164892 -2.164892 3.064315\n2.164892 2.164892 -3.064315\nLi Be Cd\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Li\n0.250000 0.750000 0.499999 Li\n0.500001 0.500001 0.000000 Be\n0.750000 0.250000 0.499999 Cd\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Li",
"Be",
"Cd"
],
"chemical_system": "Be-Cd-Li",
"density": 3.911088629903742,
"density_atomic": 0.06962963550725007,
"volume": 57.446803661402285,
"volume_molar": 8.6488184465262,
"formula_full": "Li2 Be1 Cd1",
"formula_reduced": "Li2BeCd",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.3271739625000001,
"spacegroup": 216
},
{
"id": "jvasp-65318",
"created_at": "2022-09-04T14:35:41.045616Z",
"updated_at": "2022-09-04T14:35:41.045639Z",
"structure_string": "La1 Be1 Cd4\n1.0\n0.000000 4.148810 4.148810\n4.148810 0.000000 4.148810\n4.148810 4.148810 0.000000\nLa Be Cd\n1 1 4\ndirect\n0.250000 0.250000 0.250000 La\n0.000000 0.000000 0.000000 Be\n0.124160 0.625280 0.625280 Cd\n0.625280 0.625280 0.625280 Cd\n0.625280 0.124160 0.625280 Cd\n0.625280 0.625280 0.124160 Cd\n",
"nsites": 6,
"nelements": 3,
"elements": [
"La",
"Be",
"Cd"
],
"chemical_system": "Be-Cd-La",
"density": 6.947542023574452,
"density_atomic": 0.04200980020361743,
"volume": 142.82381660751972,
"volume_molar": 14.335085458181823,
"formula_full": "La1 Be1 Cd4",
"formula_reduced": "LaBeCd4",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.0,
"spacegroup": 216
},
{
"id": "jvasp-70074",
"created_at": "2022-09-04T14:36:03.120605Z",
"updated_at": "2022-09-04T14:36:03.120635Z",
"structure_string": "La1 Be2 Cd1\n1.0\n3.032934 0.000000 -0.000000\n0.000000 3.032934 0.000000\n0.000000 0.000000 7.737647\nLa Be Cd\n1 2 1\ndirect\n0.499999 0.499999 0.786287 La\n0.000000 0.000000 0.085104 Be\n0.499999 0.499999 0.194639 Be\n0.000000 0.000000 0.433971 Cd\n",
"nsites": 4,
"nelements": 3,
"elements": [
"La",
"Be",
"Cd"
],
"chemical_system": "Be-Cd-La",
"density": 6.283714805633492,
"density_atomic": 0.05619855631441034,
"volume": 71.17620562388586,
"volume_molar": 10.715828225743609,
"formula_full": "La1 Be2 Cd1",
"formula_reduced": "LaBe2Cd",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.2293798562500005,
"spacegroup": 99
},
{
"id": "jvasp-74480",
"created_at": "2022-09-04T14:35:46.027565Z",
"updated_at": "2022-09-04T14:35:46.027583Z",
"structure_string": "K1 Be2 Cd1\n1.0\n-2.440490 2.440490 3.451822\n2.440490 -2.440490 3.451822\n2.440490 2.440490 -3.451822\nK Be Cd\n1 2 1\ndirect\n0.750000 0.250000 0.500000 K\n0.000000 0.000000 0.000000 Be\n0.250000 0.750000 0.500000 Be\n0.500000 0.500000 0.000000 Cd\n",
"nsites": 4,
"nelements": 3,
"elements": [
"K",
"Be",
"Cd"
],
"chemical_system": "Be-Cd-K",
"density": 3.4232813734614425,
"density_atomic": 0.04864044535531352,
"volume": 82.23608913899545,
"volume_molar": 12.380932608673445,
"formula_full": "K1 Be2 Cd1",
"formula_reduced": "KBe2Cd",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.7429532875,
"spacegroup": 216
},
{
"id": "jvasp-70897",
"created_at": "2022-09-04T14:36:09.621705Z",
"updated_at": "2022-09-04T14:36:09.621736Z",
"structure_string": "K1 Be2 Cd1\n1.0\n3.330984 -4.726759 0.000000\n3.330984 4.726759 0.000000\n0.000000 0.000000 2.668433\nK Be Cd\n1 2 1\ndirect\n-0.000000 0.500000 0.499999 K\n0.000000 0.000000 0.000000 Be\n0.499999 0.499999 0.000000 Be\n0.500000 -0.000000 0.499999 Cd\n",
"nsites": 4,
"nelements": 3,
"elements": [
"K",
"Be",
"Cd"
],
"chemical_system": "Be-Cd-K",
"density": 3.35029262042039,
"density_atomic": 0.047603368624966926,
"volume": 84.02766685511595,
"volume_molar": 12.650660938397369,
"formula_full": "K1 Be2 Cd1",
"formula_reduced": "KBe2Cd",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.7570707875,
"spacegroup": 65
},
{
"id": "jvasp-67864",
"created_at": "2022-09-04T14:36:01.444454Z",
"updated_at": "2022-09-04T14:36:01.444466Z",
"structure_string": "K1 Be1 Cd1\n1.0\n-1.743631 1.743631 6.154316\n1.743631 -1.743631 6.154316\n1.743631 1.743631 -6.154316\nK Be Cd\n1 1 1\ndirect\n0.666378 0.666378 0.000000 K\n0.940733 0.940733 0.000000 Be\n0.392890 0.392890 0.000000 Cd\n",
"nsites": 3,
"nelements": 3,
"elements": [
"K",
"Be",
"Cd"
],
"chemical_system": "Be-Cd-K",
"density": 3.5615029756411847,
"density_atomic": 0.040084115801800276,
"volume": 74.84261383820427,
"volume_molar": 15.023758512666335,
"formula_full": "K1 Be1 Cd1",
"formula_reduced": "KBeCd",
"formula_anonymous": "ABC",
"energy_above_hull": 0.2474690166666665,
"spacegroup": 107
},
{
"id": "jvasp-74873",
"created_at": "2022-09-04T14:36:20.275949Z",
"updated_at": "2022-09-04T14:36:20.275956Z",
"structure_string": "K1 Be1 Cd2\n1.0\n-2.571636 2.571636 3.651757\n2.571636 -2.571636 3.651757\n2.571636 2.571636 -3.651757\nK Be Cd\n1 1 2\ndirect\n0.500000 0.500000 0.000000 K\n0.750001 0.250000 0.500001 Be\n0.000000 0.000000 0.000000 Cd\n0.250000 0.750001 0.500001 Cd\n",
"nsites": 4,
"nelements": 3,
"elements": [
"K",
"Be",
"Cd"
],
"chemical_system": "Be-Cd-K",
"density": 4.691626890234357,
"density_atomic": 0.041407511966503455,
"volume": 96.60082941558512,
"volume_molar": 14.543594806835054,
"formula_full": "K1 Be1 Cd2",
"formula_reduced": "KBeCd2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 216
},
{
"id": "jvasp-70901",
"created_at": "2022-09-04T14:36:18.049599Z",
"updated_at": "2022-09-04T14:36:18.049623Z",
"structure_string": "Be1 Cd1 Ir2\n1.0\n2.900512 -0.000000 0.000000\n-0.000000 2.900512 -0.000000\n0.000000 0.000000 6.834214\nBe Cd Ir\n1 1 2\ndirect\n0.000000 0.000000 0.448612 Be\n0.500000 0.500000 0.731316 Cd\n0.000000 0.000000 0.020707 Ir\n0.500000 0.500000 0.299363 Ir\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Cd",
"Ir"
],
"chemical_system": "Be-Cd-Ir",
"density": 14.609626423479776,
"density_atomic": 0.06957001298727435,
"volume": 57.49603641344259,
"volume_molar": 8.65623061059592,
"formula_full": "Be1 Cd1 Ir2",
"formula_reduced": "BeCdIr2",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.2901220125,
"spacegroup": 99
}
]
}