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=energy_above_hull&page=97",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=energy_above_hull&page=95",
"results": [
{
"id": "jvasp-106470",
"created_at": "2022-09-04T14:36:50.180193Z",
"updated_at": "2022-09-04T14:36:50.180223Z",
"structure_string": "Li1 Ag1 F2\n1.0\n2.926208 0.016162 5.811431\n1.393262 2.573281 5.811431\n0.026960 0.016162 6.506512\nLi Ag F\n1 1 2\ndirect\n0.500000 0.499999 0.500000 Li\n0.000000 0.000000 0.000000 Ag\n0.110186 0.110185 0.110186 F\n0.889815 0.889812 0.889814 F\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Li",
"Ag",
"F"
],
"chemical_system": "Ag-F-Li",
"density": 5.2531391828766845,
"density_atomic": 0.08281125682789182,
"volume": 48.30261190593055,
"volume_molar": 7.272128199329141,
"formula_full": "Li1 Ag1 F2",
"formula_reduced": "LiAgF2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 166
},
{
"id": "jvasp-56825",
"created_at": "2022-09-04T14:36:50.376393Z",
"updated_at": "2022-09-04T14:36:50.376415Z",
"structure_string": "Rb2 Hg2 Pd1 Br8\n1.0\n6.684631 0.022477 1.935016\n2.861186 6.041390 1.935016\n-0.066775 -0.042418 10.236648\nRb Hg Pd Br\n2 2 1 8\ndirect\n0.399050 0.399050 0.828077 Rb\n0.600950 0.600950 0.171924 Rb\n0.133010 0.133010 0.602040 Hg\n0.866990 0.866990 0.397961 Hg\n0.000000 0.000000 0.000000 Pd\n0.353263 0.353263 0.497171 Br\n0.894303 0.379084 0.866517 Br\n0.088242 0.088242 0.303692 Br\n0.911759 0.911759 0.696309 Br\n0.646737 0.646737 0.502830 Br\n0.105696 0.620916 0.133484 Br\n0.620916 0.105696 0.133484 Br\n0.379084 0.894304 0.866517 Br\n",
"nsites": 13,
"nelements": 4,
"elements": [
"Rb",
"Hg",
"Pd",
"Br"
],
"chemical_system": "Br-Hg-Pd-Rb",
"density": 5.287629048457458,
"density_atomic": 0.03141350595941488,
"volume": 413.83473773336635,
"volume_molar": 19.170546476984736,
"formula_full": "Rb2 Hg2 Pd1 Br8",
"formula_reduced": "Rb2Hg2PdBr8",
"formula_anonymous": "AB2C2D8",
"energy_above_hull": 0.0,
"spacegroup": 12
},
{
"id": "jvasp-86695",
"created_at": "2022-09-04T14:35:41.048650Z",
"updated_at": "2022-09-04T14:35:41.048673Z",
"structure_string": "Rb2 Hg2 Pd1 Cl8\n1.0\n6.368097 0.039047 1.932409\n2.754388 5.741736 1.932409\n-0.037039 -0.023470 9.834079\nRb Hg Pd Cl\n2 2 1 8\ndirect\n0.397295 0.397295 0.829109 Rb\n0.602705 0.602706 0.170891 Rb\n0.866074 0.866075 0.400908 Hg\n0.133926 0.133926 0.599092 Hg\n0.000000 0.000000 0.000000 Pd\n0.085111 0.085111 0.305976 Cl\n0.106719 0.623961 0.134386 Cl\n0.647880 0.647881 0.503489 Cl\n0.376039 0.893282 0.865614 Cl\n0.352119 0.352120 0.496511 Cl\n0.623961 0.106720 0.134386 Cl\n0.893281 0.376040 0.865614 Cl\n0.914889 0.914890 0.694024 Cl\n",
"nsites": 13,
"nelements": 4,
"elements": [
"Rb",
"Hg",
"Pd",
"Cl"
],
"chemical_system": "Cl-Hg-Pd-Rb",
"density": 4.449349676303782,
"density_atomic": 0.03620292627704166,
"volume": 359.08699480583266,
"volume_molar": 16.634403290816255,
"formula_full": "Rb2 Hg2 Pd1 Cl8",
"formula_reduced": "Rb2Hg2PdCl8",
"formula_anonymous": "AB2C2D8",
"energy_above_hull": 0.0,
"spacegroup": 12
},
{
"id": "jvasp-98281",
"created_at": "2022-09-04T14:36:12.132389Z",
"updated_at": "2022-09-04T14:36:12.132408Z",
"structure_string": "Sr2 Cd22\n1.0\n7.125361 -0.000000 3.223396\n3.562680 8.555003 1.611698\n0.036566 -0.000000 9.406221\nSr Cd\n2 22\ndirect\n0.375000 0.250000 0.750000 Sr\n0.625000 0.750000 0.250000 Sr\n0.449238 0.831428 0.927996 Cd\n0.791339 0.927996 0.831428 Cd\n0.280666 0.927996 0.668572 Cd\n0.550762 0.168572 0.072004 Cd\n0.449238 0.427996 0.331428 Cd\n0.719334 0.072004 0.331428 Cd\n0.791338 0.331428 0.427996 Cd\n0.280666 0.168572 0.427996 Cd\n0.500000 0.500000 0.000000 Cd\n0.550763 0.572004 0.668572 Cd\n0.875000 0.250000 0.750000 Cd\n0.877234 0.331428 0.072004 Cd\n0.125000 0.750000 0.250000 Cd\n0.122767 0.668572 0.927996 Cd\n0.877234 0.572004 0.831428 Cd\n0.208662 0.668572 0.572004 Cd\n0.122766 0.427996 0.168572 Cd\n0.208662 0.072004 0.168572 Cd\n0.000000 0.000000 0.000000 Cd\n0.719335 0.831428 0.572004 Cd\n0.000000 0.000000 0.500000 Cd\n0.000000 0.500000 0.500000 Cd\n",
"nsites": 24,
"nelements": 2,
"elements": [
"Sr",
"Cd"
],
"chemical_system": "Cd-Sr",
"density": 7.683083187000678,
"density_atomic": 0.041930829214318045,
"volume": 572.3712230285387,
"volume_molar": 14.362083633546723,
"formula_full": "Sr2 Cd22",
"formula_reduced": "SrCd11",
"formula_anonymous": "AB11",
"energy_above_hull": 0.0,
"spacegroup": 141
},
{
"id": "jvasp-106465",
"created_at": "2022-09-04T14:36:50.185745Z",
"updated_at": "2022-09-04T14:36:50.185767Z",
"structure_string": "Rb2 Li1 Ti1 F6\n1.0\n5.059018 -0.000000 2.920825\n1.686339 4.769688 2.920825\n-0.000000 -0.000000 5.841651\nRb Li Ti F\n2 1 1 6\ndirect\n0.250000 0.250000 0.250000 Rb\n0.750000 0.750000 0.750001 Rb\n0.500000 0.500000 0.500001 Li\n0.000000 0.000000 0.000000 Ti\n0.241949 0.241949 0.758052 F\n0.241949 0.758052 0.758052 F\n0.758052 0.758052 0.241949 F\n0.241949 0.758052 0.241949 F\n0.758052 0.241949 0.758052 F\n0.758052 0.241949 0.241949 F\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Rb",
"Li",
"Ti",
"F"
],
"chemical_system": "F-Li-Rb-Ti",
"density": 4.002177363571968,
"density_atomic": 0.07094277898633565,
"volume": 140.95867321360655,
"volume_molar": 8.488729714351802,
"formula_full": "Rb2 Li1 Ti1 F6",
"formula_reduced": "Rb2LiTiF6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-68080",
"created_at": "2022-09-04T14:36:08.379723Z",
"updated_at": "2022-09-04T14:36:08.379758Z",
"structure_string": "Be1 Zn2 Ge1\n1.0\n2.770508 0.000000 -0.000000\n-0.000000 2.770508 -0.000000\n-0.000000 -0.000000 7.684659\nBe Zn Ge\n1 2 1\ndirect\n0.000000 0.000000 0.480224 Be\n0.000000 0.000000 0.024490 Zn\n0.500000 0.500000 0.282678 Zn\n0.500000 0.500000 0.712609 Ge\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Zn",
"Ge"
],
"chemical_system": "Be-Ge-Zn",
"density": 5.981411335878607,
"density_atomic": 0.06781356457927572,
"volume": 58.98524911375072,
"volume_molar": 8.880436823166802,
"formula_full": "Be1 Zn2 Ge1",
"formula_reduced": "BeZn2Ge",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 99
},
{
"id": "jvasp-65530",
"created_at": "2022-09-04T14:35:42.318327Z",
"updated_at": "2022-09-04T14:35:42.318358Z",
"structure_string": "K1 Ba1 Cd2\n1.0\n4.202187 -0.000000 0.000000\n0.000000 4.202187 -0.000000\n-0.000000 -0.000000 8.555293\nK Ba Cd\n1 1 2\ndirect\n0.500000 0.500000 0.000000 K\n0.500000 0.500000 0.500000 Ba\n0.000000 0.000000 0.736642 Cd\n0.000000 0.000000 0.263358 Cd\n",
"nsites": 4,
"nelements": 3,
"elements": [
"K",
"Ba",
"Cd"
],
"chemical_system": "Ba-Cd-K",
"density": 4.410375662987993,
"density_atomic": 0.026477340090433555,
"volume": 151.07257701634566,
"volume_molar": 22.744508094209362,
"formula_full": "K1 Ba1 Cd2",
"formula_reduced": "KBaCd2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 123
},
{
"id": "jvasp-92187",
"created_at": "2022-09-04T14:35:44.914189Z",
"updated_at": "2022-09-04T14:35:44.914225Z",
"structure_string": "Ca1 Ce1 Mg6\n1.0\n6.808832 -0.001815 0.000000\n-3.405988 5.895715 0.000000\n0.000000 0.000000 5.236010\nCa Ce Mg\n1 1 6\ndirect\n0.083123 0.416876 0.250000 Ca\n0.416859 0.083142 0.750000 Ce\n0.078951 0.914738 0.250000 Mg\n0.585261 0.421048 0.250000 Mg\n0.585674 0.914326 0.250000 Mg\n0.432685 0.591087 0.750000 Mg\n0.908912 0.067315 0.750000 Mg\n0.908530 0.591469 0.750000 Mg\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Ca",
"Ce",
"Mg"
],
"chemical_system": "Ca-Ce-Mg",
"density": 2.576060073449508,
"density_atomic": 0.038066881883272334,
"volume": 210.15643005726264,
"volume_molar": 15.819895042799132,
"formula_full": "Ca1 Ce1 Mg6",
"formula_reduced": "CaCeMg6",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.0,
"spacegroup": 187
},
{
"id": "jvasp-65213",
"created_at": "2022-09-04T14:35:48.270517Z",
"updated_at": "2022-09-04T14:35:48.270548Z",
"structure_string": "Mg1 Be1 Cu4\n1.0\n-0.000000 3.417629 3.417629\n3.417629 0.000000 3.417629\n3.417629 3.417629 -0.000000\nMg Be Cu\n1 1 4\ndirect\n0.250000 0.250000 0.250000 Mg\n0.000000 0.000000 0.000000 Be\n0.123864 0.625379 0.625379 Cu\n0.625379 0.625379 0.625379 Cu\n0.625379 0.123864 0.625379 Cu\n0.625379 0.625379 0.123864 Cu\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Mg",
"Be",
"Cu"
],
"chemical_system": "Be-Cu-Mg",
"density": 5.979763221773482,
"density_atomic": 0.07515303191783532,
"volume": 79.83709834301548,
"volume_molar": 8.013170734860035,
"formula_full": "Mg1 Be1 Cu4",
"formula_reduced": "MgBeCu4",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.0,
"spacegroup": 216
},
{
"id": "jvasp-90206",
"created_at": "2022-09-04T14:36:20.396882Z",
"updated_at": "2022-09-04T14:36:20.396895Z",
"structure_string": "Dy3 Cd3 Cu3\n1.0\n0.000000 0.000000 -3.880255\n-3.723903 -6.449990 0.000000\n-3.723800 6.449929 0.000000\nDy Cd Cu\n3 3 3\ndirect\n0.499999 0.589929 -0.000000 Dy\n0.499999 0.410048 0.410059 Dy\n0.499999 0.999989 0.589940 Dy\n0.000000 0.253785 -0.000000 Cd\n0.000000 0.746193 0.746205 Cd\n0.000000 0.999988 0.253794 Cd\n0.000000 0.333323 0.666667 Cu\n0.000000 0.666656 0.333333 Cu\n0.499999 0.999988 -0.000000 Cu\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Dy",
"Cd",
"Cu"
],
"chemical_system": "Cd-Cu-Dy",
"density": 9.045534793945498,
"density_atomic": 0.04828396262814088,
"volume": 186.39729446635386,
"volume_molar": 12.472341606217245,
"formula_full": "Dy3 Cd3 Cu3",
"formula_reduced": "DyCdCu",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0,
"spacegroup": 189
},
{
"id": "jvasp-69359",
"created_at": "2022-09-04T14:35:49.693742Z",
"updated_at": "2022-09-04T14:35:49.693767Z",
"structure_string": "Ba1 Na2 Ca1\n1.0\n4.423358 0.000000 0.000000\n-0.000000 4.419967 0.000000\n0.000000 0.000000 8.845214\nBa Na Ca\n1 2 1\ndirect\n0.500000 0.500000 0.000000 Ba\n0.000000 0.000000 0.723953 Na\n0.000000 0.000000 0.276047 Na\n0.500000 0.500000 0.500000 Ca\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"Na",
"Ca"
],
"chemical_system": "Ba-Ca-Na",
"density": 2.1449775265939373,
"density_atomic": 0.023130260813784578,
"volume": 172.93363149697745,
"volume_molar": 26.035766775319193,
"formula_full": "Ba1 Na2 Ca1",
"formula_reduced": "BaNa2Ca",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 123
},
{
"id": "jvasp-19986",
"created_at": "2022-09-04T14:37:50.049801Z",
"updated_at": "2022-09-04T14:37:50.049831Z",
"structure_string": "Ba1 Ag5\n1.0\n2.935027 -5.083615 0.000000\n2.935027 5.083615 -0.000000\n-0.000000 -0.000000 4.608002\nBa Ag\n1 5\ndirect\n0.000000 0.000000 0.000000 Ba\n0.333334 0.666667 0.000000 Ag\n0.666667 0.333334 0.000000 Ag\n0.000001 0.500000 0.500000 Ag\n0.500001 0.500001 0.500000 Ag\n0.500000 0.000001 0.500000 Ag\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Ba",
"Ag"
],
"chemical_system": "Ag-Ba",
"density": 8.171416149417754,
"density_atomic": 0.04363388096733106,
"volume": 137.5078234386768,
"volume_molar": 13.801524472482317,
"formula_full": "Ba1 Ag5",
"formula_reduced": "BaAg5",
"formula_anonymous": "AB5",
"energy_above_hull": 0.0,
"spacegroup": 191
}
]
}