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=4146",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-energy_above_hull&page=4144",
"results": [
{
"id": "jvasp-101751",
"created_at": "2022-09-04T14:36:35.721283Z",
"updated_at": "2022-09-04T14:36:35.721314Z",
"structure_string": "Ag3 Ge1\n1.0\n2.962954 0.000000 0.000000\n-1.481478 2.565993 0.000000\n-0.000000 0.000000 9.463014\nAg Ge\n3 1\ndirect\n0.333332 0.666666 -0.000000 Ag\n0.666665 0.333333 0.751425 Ag\n0.666665 0.333333 0.248575 Ag\n0.333332 0.666666 0.500000 Ge\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ag",
"Ge"
],
"chemical_system": "Ag-Ge",
"density": 9.145397680971778,
"density_atomic": 0.05559684312167012,
"volume": 71.94653105116521,
"volume_molar": 10.831803429595693,
"formula_full": "Ag3 Ge1",
"formula_reduced": "Ag3Ge",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0197294325,
"spacegroup": 187
},
{
"id": "jvasp-57084",
"created_at": "2022-09-04T14:37:50.278112Z",
"updated_at": "2022-09-04T14:37:50.278148Z",
"structure_string": "Rb2 Na1 Mo1 F6\n1.0\n5.291677 -0.000000 3.055152\n1.763892 4.989042 3.055152\n-0.000000 -0.000000 6.110303\nRb Na Mo F\n2 1 1 6\ndirect\n0.250000 0.250000 0.250000 Rb\n0.750000 0.750000 0.749999 Rb\n0.500000 0.500000 0.500000 Na\n0.000000 0.000000 0.000000 Mo\n0.239061 0.760938 0.760938 F\n0.239061 0.760938 0.239061 F\n0.760939 0.239061 0.760938 F\n0.239062 0.239061 0.760938 F\n0.760939 0.239061 0.239061 F\n0.760939 0.760938 0.239061 F\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Rb",
"Na",
"Mo",
"F"
],
"chemical_system": "F-Mo-Na-Rb",
"density": 4.157212030315537,
"density_atomic": 0.061990732183394306,
"volume": 161.3144360098192,
"volume_molar": 9.714582402711438,
"formula_full": "Rb2 Na1 Mo1 F6",
"formula_reduced": "Rb2NaMoF6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0197156594999999,
"spacegroup": 225
},
{
"id": "jvasp-52201",
"created_at": "2022-09-04T14:38:34.872406Z",
"updated_at": "2022-09-04T14:38:34.872438Z",
"structure_string": "Li2 Cu6 F14\n1.0\n6.889605 0.068005 0.022340\n-3.067534 6.169401 -0.022340\n-2.871411 1.759503 6.069640\nLi Cu F\n2 6 14\ndirect\n0.500001 0.500000 0.500000 Li\n0.500001 0.500000 -0.000000 Li\n0.000000 0.500000 0.500000 Cu\n0.000000 0.500000 0.000000 Cu\n-0.000000 -0.000000 0.500000 Cu\n0.000000 0.000000 0.000000 Cu\n0.500000 0.000000 0.500000 Cu\n0.500001 0.000000 -0.000000 Cu\n0.593043 0.316890 0.408493 F\n0.307339 0.138511 0.990945 F\n0.895971 0.895969 0.750000 F\n0.683111 0.406957 0.908493 F\n0.354570 -0.005576 0.694191 F\n0.645431 0.005577 0.305809 F\n0.406958 0.683110 0.591507 F\n0.104031 0.104031 0.250000 F\n0.692662 0.861489 0.009055 F\n0.861490 0.692661 0.490945 F\n0.138512 0.307339 0.509055 F\n-0.005576 0.354569 0.805809 F\n0.316890 0.593043 0.091507 F\n0.005577 0.645430 0.194191 F\n",
"nsites": 22,
"nelements": 3,
"elements": [
"Li",
"Cu",
"F"
],
"chemical_system": "Cu-F-Li",
"density": 4.225637324951151,
"density_atomic": 0.08467890448370435,
"volume": 259.80496717731734,
"volume_molar": 7.111736738586296,
"formula_full": "Li2 Cu6 F14",
"formula_reduced": "LiCu3F7",
"formula_anonymous": "AB3C7",
"energy_above_hull": 0.019680909090909,
"spacegroup": 15
},
{
"id": "jvasp-64564",
"created_at": "2022-09-04T14:36:09.939423Z",
"updated_at": "2022-09-04T14:36:09.939449Z",
"structure_string": "Ba4 Sr1 Ni1\n1.0\n-0.000000 5.529175 5.529175\n5.529175 -0.000000 5.529175\n5.529175 5.529175 -0.000000\nBa Sr Ni\n4 1 1\ndirect\n0.126415 0.624527 0.624527 Ba\n0.624527 0.624527 0.624527 Ba\n0.624527 0.126415 0.624527 Ba\n0.624527 0.624527 0.126415 Ba\n0.000000 0.000000 0.000000 Sr\n0.250000 0.250000 0.250000 Ni\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Sr",
"Ni"
],
"chemical_system": "Ba-Ni-Sr",
"density": 3.4167328941356443,
"density_atomic": 0.017747625160684538,
"volume": 338.07340112701456,
"volume_molar": 33.93209347998041,
"formula_full": "Ba4 Sr1 Ni1",
"formula_reduced": "Ba4SrNi",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.0196320983333332,
"spacegroup": 216
},
{
"id": "jvasp-25397",
"created_at": "2022-09-04T14:37:57.157172Z",
"updated_at": "2022-09-04T14:37:57.157184Z",
"structure_string": "Pr3\n1.0\n-1.856145 -3.214936 -0.000000\n-1.856145 3.214936 0.000000\n-0.000000 2.143290 -8.945308\nPr\n3\ndirect\n0.000000 0.000000 0.000000 Pr\n0.777219 0.222778 0.331659 Pr\n0.222778 0.777219 0.668341 Pr\n",
"nsites": 3,
"nelements": 1,
"elements": [
"Pr"
],
"chemical_system": "Pr",
"density": 6.57499456734334,
"density_atomic": 0.02810034997706673,
"volume": 106.76023616959793,
"volume_molar": 21.4308389928054,
"formula_full": "Pr3",
"formula_reduced": "Pr",
"formula_anonymous": "A",
"energy_above_hull": 0.0193799999999999,
"spacegroup": 166
},
{
"id": "jvasp-74471",
"created_at": "2022-09-04T14:35:49.980018Z",
"updated_at": "2022-09-04T14:35:49.980044Z",
"structure_string": "Sr2 Be1 Tl1\n1.0\n5.552737 0.000000 0.000000\n0.000000 5.552737 -0.000000\n-0.000000 0.000000 3.924415\nSr Be Tl\n2 1 1\ndirect\n0.500000 0.000000 0.000000 Sr\n0.000000 0.500000 0.000000 Sr\n0.000000 0.000000 0.500001 Be\n0.500000 0.500000 0.500001 Tl\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sr",
"Be",
"Tl"
],
"chemical_system": "Be-Sr-Tl",
"density": 5.3333785643787595,
"density_atomic": 0.03305756467409224,
"volume": 121.00104891074648,
"volume_molar": 18.217133716204,
"formula_full": "Sr2 Be1 Tl1",
"formula_reduced": "Sr2BeTl",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0192178299999999,
"spacegroup": 123
},
{
"id": "jvasp-25418",
"created_at": "2022-09-04T14:38:30.305516Z",
"updated_at": "2022-09-04T14:38:30.305532Z",
"structure_string": "Y1\n1.0\n3.075029 -0.000000 1.775369\n1.025010 2.899165 1.775369\n-0.000000 -0.000000 3.550738\nY\n1\ndirect\n0.000000 0.000000 0.000000 Y\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Y"
],
"chemical_system": "Y",
"density": 4.6637864792120025,
"density_atomic": 0.03159069809478837,
"volume": 31.65488768242743,
"volume_molar": 19.063018936556816,
"formula_full": "Y1",
"formula_reduced": "Y",
"formula_anonymous": "A",
"energy_above_hull": 0.0192099999999997,
"spacegroup": 225
},
{
"id": "jvasp-14836",
"created_at": "2022-09-04T14:36:08.403485Z",
"updated_at": "2022-09-04T14:36:08.403503Z",
"structure_string": "Y1\n1.0\n3.075028 -0.000000 1.775369\n1.025010 2.899164 1.775369\n-0.000000 -0.000000 3.550737\nY\n1\ndirect\n0.000000 0.000000 0.000000 Y\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Y"
],
"chemical_system": "Y",
"density": 4.663790918014085,
"density_atomic": 0.03159072816152859,
"volume": 31.654857554622847,
"volume_molar": 19.06300079316882,
"formula_full": "Y1",
"formula_reduced": "Y",
"formula_anonymous": "A",
"energy_above_hull": 0.0192099999999997,
"spacegroup": 225
},
{
"id": "jvasp-64174",
"created_at": "2022-09-04T14:36:15.407162Z",
"updated_at": "2022-09-04T14:36:15.407194Z",
"structure_string": "K1 Ba1 Cd1\n1.0\n-0.000000 4.177189 4.177189\n4.177189 -0.000000 4.177189\n4.177189 4.177189 -0.000000\nK Ba Cd\n1 1 1\ndirect\n0.500000 0.500000 0.500000 K\n0.750000 0.750000 0.750000 Ba\n0.000000 0.000000 0.000000 Cd\n",
"nsites": 3,
"nelements": 3,
"elements": [
"K",
"Ba",
"Cd"
],
"chemical_system": "Ba-Cd-K",
"density": 3.290171209608842,
"density_atomic": 0.020579692534087122,
"volume": 145.77477263233925,
"volume_molar": 29.26254000163142,
"formula_full": "K1 Ba1 Cd1",
"formula_reduced": "KBaCd",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0191406616666667,
"spacegroup": 216
},
{
"id": "jvasp-50849",
"created_at": "2022-09-04T14:37:15.350583Z",
"updated_at": "2022-09-04T14:37:15.350609Z",
"structure_string": "Li2 Ag4 F12\n1.0\n0.000000 4.795290 -0.004562\n10.257647 0.000000 0.000000\n0.000000 -0.004187 -4.794963\nLi Ag F\n2 4 12\ndirect\n0.000000 0.999932 0.000000 Li\n0.500000 0.500077 0.499999 Li\n0.000000 0.336236 0.000000 Ag\n0.000000 0.663764 0.000000 Ag\n0.500000 0.163776 0.499999 Ag\n0.500000 0.836253 0.499999 Ag\n0.791826 0.500009 0.791851 F\n0.708174 -0.000003 0.291852 F\n0.697761 0.332360 0.302270 F\n0.697728 0.667660 0.302302 F\n0.302271 0.667660 0.697697 F\n0.208173 0.500009 0.208148 F\n0.291825 -0.000003 0.708147 F\n0.802243 0.167646 0.802275 F\n0.197756 0.167646 0.197724 F\n0.197732 0.832350 0.197700 F\n0.302238 0.332360 0.697729 F\n0.802267 0.832350 0.802298 F\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Li",
"Ag",
"F"
],
"chemical_system": "Ag-F-Li",
"density": 4.740590607166816,
"density_atomic": 0.07631752152503433,
"volume": 235.85671599798331,
"volume_molar": 7.890901905173331,
"formula_full": "Li2 Ag4 F12",
"formula_reduced": "LiAg2F6",
"formula_anonymous": "AB2C6",
"energy_above_hull": 0.0191247222222223,
"spacegroup": 136
},
{
"id": "jvasp-86217",
"created_at": "2022-09-04T14:35:41.587993Z",
"updated_at": "2022-09-04T14:35:41.588010Z",
"structure_string": "Ca4 Te4\n1.0\n4.433675 -0.000000 0.000000\n-0.000000 7.609439 0.000000\n0.000000 0.000000 7.679506\nCa Te\n4 4\ndirect\n0.250000 0.499995 0.750014 Ca\n0.750001 0.500005 0.249987 Ca\n0.250000 -0.000005 0.749987 Ca\n0.750001 0.000005 0.250014 Ca\n0.250000 0.749999 0.083323 Te\n0.750001 0.250001 0.916677 Te\n0.250000 0.249999 0.416677 Te\n0.750001 0.750001 0.583323 Te\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Ca",
"Te"
],
"chemical_system": "Ca-Te",
"density": 4.298682753913921,
"density_atomic": 0.0308773633220818,
"volume": 259.0894797768836,
"volume_molar": 19.50341645814458,
"formula_full": "Ca4 Te4",
"formula_reduced": "CaTe",
"formula_anonymous": "AB",
"energy_above_hull": 0.0191049999999999,
"spacegroup": 194
},
{
"id": "jvasp-86819",
"created_at": "2022-09-04T14:36:18.985163Z",
"updated_at": "2022-09-04T14:36:18.985202Z",
"structure_string": "Ca4 Te4\n1.0\n4.433654 -0.000000 0.000000\n-0.000000 7.609464 0.000000\n0.000000 0.000000 7.679504\nCa Te\n4 4\ndirect\n0.250000 0.499995 0.750014 Ca\n0.749999 0.500005 0.249985 Ca\n0.250000 -0.000005 0.749985 Ca\n0.749999 0.000005 0.250014 Ca\n0.250000 0.750000 0.083319 Te\n0.749999 0.250000 0.916680 Te\n0.250000 0.250000 0.416680 Te\n0.749999 0.750000 0.583319 Te\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Ca",
"Te"
],
"chemical_system": "Ca-Te",
"density": 4.298690111261177,
"density_atomic": 0.030877416169778946,
"volume": 259.0890363368533,
"volume_molar": 19.503383077416068,
"formula_full": "Ca4 Te4",
"formula_reduced": "CaTe",
"formula_anonymous": "AB",
"energy_above_hull": 0.0191049999999999,
"spacegroup": 194
}
]
}