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=-elements&page=3539",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-elements&page=3537",
"results": [
{
"id": "jvasp-55005",
"created_at": "2022-09-04T14:37:01.774939Z",
"updated_at": "2022-09-04T14:37:01.774963Z",
"structure_string": "Zr6 Cl12\n1.0\n7.681127 0.001844 -2.425316\n-3.309638 6.931522 -2.425316\n0.001162 0.001844 8.054928\nZr Cl\n6 12\ndirect\n0.035896 0.106025 0.306216 Zr\n0.693783 0.964103 0.893974 Zr\n0.306216 0.035896 0.106025 Zr\n0.106025 0.306216 0.035896 Zr\n0.893974 0.693783 0.964103 Zr\n0.964104 0.893974 0.693783 Zr\n0.379518 0.150809 0.459776 Cl\n0.620481 0.849189 0.540222 Cl\n0.540223 0.620480 0.849189 Cl\n0.150809 0.459776 0.379518 Cl\n0.312979 0.921246 0.771092 Cl\n0.771093 0.312979 0.921246 Cl\n0.921247 0.771092 0.312979 Cl\n0.849190 0.540222 0.620480 Cl\n0.228906 0.687020 0.078752 Cl\n0.459776 0.379518 0.150809 Cl\n0.078752 0.228906 0.687020 Cl\n0.687020 0.078752 0.228906 Cl\n",
"nsites": 18,
"nelements": 2,
"elements": [
"Zr",
"Cl"
],
"chemical_system": "Cl-Zr",
"density": 3.7655567472858094,
"density_atomic": 0.041960240756971835,
"volume": 428.97751955842244,
"volume_molar": 14.352016698091518,
"formula_full": "Zr6 Cl12",
"formula_reduced": "ZrCl2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.7745575450000002,
"spacegroup": 148
},
{
"id": "jvasp-32768",
"created_at": "2022-09-04T14:37:32.997162Z",
"updated_at": "2022-09-04T14:37:32.997184Z",
"structure_string": "Zr2 Cl8\n1.0\n6.233159 0.019834 0.000000\n-2.075516 5.957252 0.000000\n0.000000 0.000000 7.366073\nZr Cl\n2 8\ndirect\n0.750000 -0.000001 0.832229 Zr\n0.250000 -0.000000 0.167770 Zr\n0.013776 0.741991 0.368978 Cl\n0.497159 0.231510 0.890557 Cl\n0.502840 0.768489 0.109442 Cl\n0.986223 0.258008 0.631022 Cl\n0.002840 0.768489 0.890557 Cl\n0.513776 0.741991 0.631022 Cl\n0.486223 0.258008 0.368978 Cl\n0.997159 0.231510 0.109442 Cl\n",
"nsites": 10,
"nelements": 2,
"elements": [
"Zr",
"Cl"
],
"chemical_system": "Cl-Zr",
"density": 2.826381061115624,
"density_atomic": 0.03651981796228587,
"volume": 273.82392788285614,
"volume_molar": 16.490062371666486,
"formula_full": "Zr2 Cl8",
"formula_reduced": "ZrCl4",
"formula_anonymous": "AB4",
"energy_above_hull": 0.6313161539999999,
"spacegroup": 13
},
{
"id": "jvasp-35752",
"created_at": "2022-09-04T14:37:30.323807Z",
"updated_at": "2022-09-04T14:37:30.323842Z",
"structure_string": "Zr2 Cd1\n1.0\n3.087020 -0.000000 -0.000000\n-0.000000 3.087020 -0.000000\n-1.543510 -1.543510 6.980176\nZr Cd\n2 1\ndirect\n0.667892 0.667892 0.335784 Zr\n0.332108 0.332108 0.664217 Zr\n0.000000 0.000000 0.000000 Cd\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Zr",
"Cd"
],
"chemical_system": "Cd-Zr",
"density": 7.3606848937371465,
"density_atomic": 0.04509994322921385,
"volume": 66.51893073906855,
"volume_molar": 13.352878803845389,
"formula_full": "Zr2 Cd1",
"formula_reduced": "Zr2Cd",
"formula_anonymous": "AB2",
"energy_above_hull": 2.113055833333333,
"spacegroup": 139
},
{
"id": "jvasp-36661",
"created_at": "2022-09-04T14:37:30.499256Z",
"updated_at": "2022-09-04T14:37:30.499276Z",
"structure_string": "Zr2 Cd2\n1.0\n3.125075 0.000000 -0.000000\n0.000000 3.125075 0.000000\n-0.000000 0.000000 9.001111\nZr Cd\n2 2\ndirect\n0.499999 0.000000 0.872920 Zr\n0.000000 0.499999 0.127080 Zr\n0.499999 0.000000 0.379425 Cd\n0.000000 0.499999 0.620575 Cd\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Zr",
"Cd"
],
"chemical_system": "Cd-Zr",
"density": 7.693332654727198,
"density_atomic": 0.045503309525653686,
"volume": 87.90569393078749,
"volume_molar": 13.234511561417,
"formula_full": "Zr2 Cd2",
"formula_reduced": "ZrCd",
"formula_anonymous": "AB",
"energy_above_hull": 0.9894315,
"spacegroup": 129
},
{
"id": "jvasp-16483",
"created_at": "2022-09-04T14:37:56.366193Z",
"updated_at": "2022-09-04T14:37:56.366204Z",
"structure_string": "Zr1 Cd3\n1.0\n4.405937 0.000000 0.000000\n0.000000 4.405937 0.000000\n0.000000 0.000000 4.405161\nZr Cd\n1 3\ndirect\n0.000000 0.000000 0.000000 Zr\n0.500000 0.000000 0.500000 Cd\n0.000000 0.500000 0.500000 Cd\n0.500000 0.500000 0.000000 Cd\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Zr",
"Cd"
],
"chemical_system": "Cd-Zr",
"density": 8.319897742788593,
"density_atomic": 0.046775844794874545,
"volume": 85.51422251251995,
"volume_molar": 12.874467123808902,
"formula_full": "Zr1 Cd3",
"formula_reduced": "ZrCd3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 221
},
{
"id": "jvasp-100266",
"created_at": "2022-09-04T14:36:32.015933Z",
"updated_at": "2022-09-04T14:36:32.015966Z",
"structure_string": "Zr3 Cd1\n1.0\n4.447814 0.000000 0.000000\n0.000000 4.447814 0.000000\n-0.000000 -0.000000 4.447814\nZr Cd\n3 1\ndirect\n0.000000 0.500000 0.500000 Zr\n0.500000 0.000000 0.500000 Zr\n0.500000 0.500000 0.000000 Zr\n0.000000 0.000000 0.000000 Cd\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Zr",
"Cd"
],
"chemical_system": "Cd-Zr",
"density": 7.28601270429405,
"density_atomic": 0.04545902730715428,
"volume": 87.99132398881059,
"volume_molar": 13.24740346798455,
"formula_full": "Zr3 Cd1",
"formula_reduced": "Zr3Cd",
"formula_anonymous": "AB3",
"energy_above_hull": 2.8578055000000004,
"spacegroup": 221
},
{
"id": "jvasp-51439",
"created_at": "2022-09-04T14:37:19.551779Z",
"updated_at": "2022-09-04T14:37:19.551797Z",
"structure_string": "Zr3 Cd2\n1.0\n5.184790 -0.000000 0.000000\n-0.000000 5.574978 0.000000\n0.000000 0.000000 5.575245\nZr Cd\n3 2\ndirect\n0.000000 0.000000 0.000000 Zr\n0.000000 0.000000 0.500000 Zr\n0.000000 0.500000 0.000000 Zr\n0.000000 0.500000 0.500000 Cd\n0.500000 0.500000 0.500000 Cd\n",
"nsites": 5,
"nelements": 2,
"elements": [
"Zr",
"Cd"
],
"chemical_system": "Cd-Zr",
"density": 5.136540860922532,
"density_atomic": 0.0310264236827894,
"volume": 161.1529595263517,
"volume_molar": 19.40971612316546,
"formula_full": "Zr3 Cd2",
"formula_reduced": "Zr3Cd2",
"formula_anonymous": "A2B3",
"energy_above_hull": 2.3761961,
"spacegroup": 123
},
{
"id": "jvasp-15060",
"created_at": "2022-09-04T14:37:07.249853Z",
"updated_at": "2022-09-04T14:37:07.249873Z",
"structure_string": "Zr1 C1\n1.0\n2.889765 -0.000000 1.668406\n0.963255 2.724497 1.668406\n0.000000 0.000000 3.336814\nZr C\n1 1\ndirect\n0.000000 0.000000 0.000000 Zr\n0.500000 0.500001 0.500000 C\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Zr",
"C"
],
"chemical_system": "C-Zr",
"density": 6.525201657014605,
"density_atomic": 0.07612882660482753,
"volume": 26.27125740925547,
"volume_molar": 7.91046050303647,
"formula_full": "Zr1 C1",
"formula_reduced": "ZrC",
"formula_anonymous": "AB",
"energy_above_hull": 2.9590222500000003,
"spacegroup": 225
},
{
"id": "jvasp-36426",
"created_at": "2022-09-04T14:37:28.898239Z",
"updated_at": "2022-09-04T14:37:28.898264Z",
"structure_string": "Zr1 C1\n1.0\n2.926587 0.000000 -0.000000\n-0.000000 2.926587 0.000000\n0.000000 -0.000000 2.926587\nZr C\n1 1\ndirect\n0.000000 0.000000 0.000000 Zr\n0.500001 0.500001 0.500001 C\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Zr",
"C"
],
"chemical_system": "C-Zr",
"density": 6.838966559684875,
"density_atomic": 0.07978948801050033,
"volume": 25.065958560064946,
"volume_molar": 7.547536536651901,
"formula_full": "Zr1 C1",
"formula_reduced": "ZrC",
"formula_anonymous": "AB",
"energy_above_hull": 3.5748222500000004,
"spacegroup": 221
},
{
"id": "jvasp-36542",
"created_at": "2022-09-04T14:37:20.068911Z",
"updated_at": "2022-09-04T14:37:20.068938Z",
"structure_string": "Zr2 C2\n1.0\n1.686715 -2.921477 -0.000000\n1.686715 2.921477 0.000000\n-0.000000 0.000000 5.328005\nZr C\n2 2\ndirect\n0.333334 0.666669 0.250000 Zr\n0.666669 0.333334 0.750001 Zr\n0.000000 0.000000 0.500000 C\n0.000000 0.000000 0.000000 C\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Zr",
"C"
],
"chemical_system": "C-Zr",
"density": 6.5292905526341025,
"density_atomic": 0.07617653131067173,
"volume": 52.509610652744854,
"volume_molar": 7.905506665090624,
"formula_full": "Zr2 C2",
"formula_reduced": "ZrC",
"formula_anonymous": "AB",
"energy_above_hull": 3.0497372500000006,
"spacegroup": 194
},
{
"id": "jvasp-36428",
"created_at": "2022-09-04T14:37:28.873903Z",
"updated_at": "2022-09-04T14:37:28.873930Z",
"structure_string": "Zr1 C1\n1.0\n2.548989 2.548989 -0.000000\n2.548989 -0.000000 -2.548989\n-0.000000 2.548989 -2.548989\nZr C\n1 1\ndirect\n0.000000 0.000000 0.000000 Zr\n0.750000 0.750000 0.750000 C\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Zr",
"C"
],
"chemical_system": "C-Zr",
"density": 5.175364207566751,
"density_atomic": 0.06038041812104535,
"volume": 33.12332147138458,
"volume_molar": 9.973665216970414,
"formula_full": "Zr1 C1",
"formula_reduced": "ZrC",
"formula_anonymous": "AB",
"energy_above_hull": 3.2677672500000003,
"spacegroup": 216
},
{
"id": "jvasp-14024",
"created_at": "2022-09-04T14:36:06.673483Z",
"updated_at": "2022-09-04T14:36:06.673509Z",
"structure_string": "Zr2 Br6\n1.0\n3.374759 -5.845254 -0.000000\n3.374759 5.845254 0.000000\n-0.000000 0.000000 6.232535\nZr Br\n2 6\ndirect\n0.000000 0.000000 0.500000 Zr\n0.000000 0.000000 0.000000 Zr\n0.000000 0.672191 0.750001 Br\n0.327809 0.000000 0.250000 Br\n0.000000 0.327809 0.250000 Br\n0.672191 0.000000 0.750001 Br\n0.327809 0.327809 0.750001 Br\n0.672191 0.672191 0.250000 Br\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Zr",
"Br"
],
"chemical_system": "Br-Zr",
"density": 4.469739704877848,
"density_atomic": 0.032534872812431816,
"volume": 245.89000381594056,
"volume_molar": 18.50980268070664,
"formula_full": "Zr2 Br6",
"formula_reduced": "ZrBr3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.65310670375,
"spacegroup": 193
}
]
}