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=id&page=1018",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=id&page=1016",
"results": [
{
"id": "jvasp-117658",
"created_at": "2022-09-04T14:38:52.874431Z",
"updated_at": "2022-09-04T14:38:52.874468Z",
"structure_string": "Ca1 Ag1 O1\n1.0\n5.741371 -1.499905 0.000000\n-4.049422 4.341109 0.000000\n0.000000 0.000000 3.490083\nCa Ag O\n1 1 1\ndirect\n0.040674 0.293083 0.000000 Ca\n0.305019 0.027641 0.000000 Ag\n0.654308 0.679278 0.000000 O\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ca",
"Ag",
"O"
],
"chemical_system": "Ag-Ca-O",
"density": 4.138070248787182,
"density_atomic": 0.04560056784978028,
"volume": 65.78865442822452,
"volume_molar": 13.206284579258844,
"formula_full": "Ca1 Ag1 O1",
"formula_reduced": "CaAgO",
"formula_anonymous": "ABC",
"energy_above_hull": 0.1677570600000002,
"spacegroup": 38
},
{
"id": "jvasp-117659",
"created_at": "2022-09-04T14:38:46.800157Z",
"updated_at": "2022-09-04T14:38:46.800184Z",
"structure_string": "Ca1 Ag1 O1\n1.0\n3.638389 -0.000000 -0.000000\n0.000000 3.638389 0.000000\n-0.000000 0.000000 6.832845\nCa Ag O\n1 1 1\ndirect\n0.000000 0.000000 0.408661 Ca\n0.000000 0.000000 -0.015853 Ag\n0.000000 0.000000 0.686569 O\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ca",
"Ag",
"O"
],
"chemical_system": "Ag-Ca-O",
"density": 3.009740372372382,
"density_atomic": 0.033166636091017276,
"volume": 90.45234469263853,
"volume_molar": 18.157225060370273,
"formula_full": "Ca1 Ag1 O1",
"formula_reduced": "CaAgO",
"formula_anonymous": "ABC",
"energy_above_hull": 0.4337437266666669,
"spacegroup": 99
},
{
"id": "jvasp-11766",
"created_at": "2022-09-04T14:37:07.955688Z",
"updated_at": "2022-09-04T14:37:07.955721Z",
"structure_string": "Ba3 Co3 O6\n1.0\n2.898541 -5.020420 0.000000\n2.898541 5.020420 -0.000000\n0.000000 -0.000000 6.830452\nBa Co O\n3 3 6\ndirect\n0.653117 0.653117 0.000000 Ba\n-0.000000 0.346883 0.666667 Ba\n0.346883 -0.000000 0.333333 Ba\n0.605577 0.605577 0.500000 Co\n-0.000000 0.394422 0.166667 Co\n0.394422 -0.000000 0.833333 Co\n0.138883 0.699136 0.970753 O\n0.560253 0.861117 0.637419 O\n0.300864 0.439747 0.304086 O\n0.699136 0.138883 0.029247 O\n0.861117 0.560253 0.362581 O\n0.439747 0.300864 0.695914 O\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Ba",
"Co",
"O"
],
"chemical_system": "Ba-Co-O",
"density": 5.720043277808166,
"density_atomic": 0.060364597301686494,
"volume": 198.7920161220845,
"volume_molar": 9.976279192094854,
"formula_full": "Ba3 Co3 O6",
"formula_reduced": "BaCoO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.5027384675000002,
"spacegroup": 152
},
{
"id": "jvasp-117660",
"created_at": "2022-09-04T14:38:52.772017Z",
"updated_at": "2022-09-04T14:38:52.772046Z",
"structure_string": "Ag2 As2 S2\n1.0\n3.754221 0.000000 0.000000\n0.000000 5.304315 0.000000\n0.000000 0.000000 6.426807\nAg As S\n2 2 2\ndirect\n0.499999 0.762010 0.001186 Ag\n0.000000 0.237990 0.501186 Ag\n0.499999 0.577446 0.388778 As\n0.000000 0.422554 0.888778 As\n0.499999 0.901541 0.603886 S\n0.000000 0.098459 0.103886 S\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ag",
"As",
"S"
],
"chemical_system": "Ag-As-S",
"density": 5.575447798169114,
"density_atomic": 0.04688207773651276,
"volume": 127.98067597859622,
"volume_molar": 12.845294088384287,
"formula_full": "Ag2 As2 S2",
"formula_reduced": "AgAsS",
"formula_anonymous": "ABC",
"energy_above_hull": 1.1589763366666666,
"spacegroup": 31
},
{
"id": "jvasp-117661",
"created_at": "2022-09-04T14:38:53.892027Z",
"updated_at": "2022-09-04T14:38:53.892050Z",
"structure_string": "Ag1 As1 S2\n1.0\n3.722414 0.000000 0.000000\n0.000000 3.722414 0.000000\n0.000000 0.000000 5.873003\nAg As S\n1 1 2\ndirect\n0.499999 0.499999 0.548598 Ag\n0.000000 0.000000 0.050306 As\n0.000000 0.000000 0.429066 S\n0.499999 0.499999 0.982028 S\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ag",
"As",
"S"
],
"chemical_system": "Ag-As-S",
"density": 5.038432509302401,
"density_atomic": 0.04915304449665789,
"volume": 81.37847901307468,
"volume_molar": 12.25181638628604,
"formula_full": "Ag1 As1 S2",
"formula_reduced": "AgAsS2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.4237922525,
"spacegroup": 99
},
{
"id": "jvasp-117662",
"created_at": "2022-09-04T14:38:53.403550Z",
"updated_at": "2022-09-04T14:38:53.403566Z",
"structure_string": "Be1 Cd1 P1\n1.0\n6.198800 0.646766 0.000000\n0.705805 3.612329 0.000000\n0.000000 0.000000 2.724436\nBe Cd P\n1 1 1\ndirect\n-0.160826 -0.127185 0.000000 Be\n0.435503 0.075005 0.000000 Cd\n-0.002650 0.294469 0.000000 P\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Be",
"Cd",
"P"
],
"chemical_system": "Be-Cd-P",
"density": 4.234468861849199,
"density_atomic": 0.05019897421047759,
"volume": 59.76217735887194,
"volume_molar": 11.996541472640395,
"formula_full": "Be1 Cd1 P1",
"formula_reduced": "BeCdP",
"formula_anonymous": "ABC",
"energy_above_hull": 0.9102671166666664,
"spacegroup": 38
},
{
"id": "jvasp-117663",
"created_at": "2022-09-04T14:38:53.553191Z",
"updated_at": "2022-09-04T14:38:53.553228Z",
"structure_string": "Be1 Cd1 P1\n1.0\n4.457923 0.000000 0.000000\n-2.228961 3.860674 -0.000000\n-0.000000 0.000000 4.221800\nBe Cd P\n1 1 1\ndirect\n0.000000 0.000000 0.000000 Be\n0.333333 0.666666 0.000000 Cd\n0.666666 0.333333 0.000000 P\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Be",
"Cd",
"P"
],
"chemical_system": "Be-Cd-P",
"density": 3.482827833380213,
"density_atomic": 0.04128838593254796,
"volume": 72.65965797018663,
"volume_molar": 14.585556262330659,
"formula_full": "Be1 Cd1 P1",
"formula_reduced": "BeCdP",
"formula_anonymous": "ABC",
"energy_above_hull": 1.1211237833333332,
"spacegroup": 187
},
{
"id": "jvasp-117665",
"created_at": "2022-09-04T14:38:51.508119Z",
"updated_at": "2022-09-04T14:38:51.508142Z",
"structure_string": "Be1 Cd1 Pd1\n1.0\n2.752448 -0.000000 0.000000\n-0.000000 2.752448 -0.000000\n0.000000 -0.000000 7.281270\nBe Cd Pd\n1 1 1\ndirect\n0.000000 0.000000 0.290660 Be\n0.000000 0.000000 0.633647 Cd\n0.000000 0.000000 0.009735 Pd\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Be",
"Cd",
"Pd"
],
"chemical_system": "Be-Cd-Pd",
"density": 6.858667562853858,
"density_atomic": 0.05438459181608402,
"volume": 55.162683028775845,
"volume_molar": 11.07324806328504,
"formula_full": "Be1 Cd1 Pd1",
"formula_reduced": "BeCdPd",
"formula_anonymous": "ABC",
"energy_above_hull": 0.6271238499999997,
"spacegroup": 99
},
{
"id": "jvasp-117666",
"created_at": "2022-09-04T14:38:46.927921Z",
"updated_at": "2022-09-04T14:38:46.927951Z",
"structure_string": "Be1 Tl1 Cl1\n1.0\n5.706191 -0.589855 0.000000\n-0.817460 4.601445 0.000000\n0.000000 0.000000 3.330576\nBe Tl Cl\n1 1 1\ndirect\n0.012674 -0.057980 0.000000 Be\n-0.131992 0.391523 0.000000 Tl\n0.351183 -0.016795 0.000000 Cl\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Be",
"Tl",
"Cl"
],
"chemical_system": "Be-Cl-Tl",
"density": 4.813642158545769,
"density_atomic": 0.034947085580836264,
"volume": 85.8440682574427,
"volume_molar": 17.232168748578932,
"formula_full": "Be1 Tl1 Cl1",
"formula_reduced": "BeTlCl",
"formula_anonymous": "ABC",
"energy_above_hull": 0.3377509224999998,
"spacegroup": 6
},
{
"id": "jvasp-117667",
"created_at": "2022-09-04T14:38:52.031824Z",
"updated_at": "2022-09-04T14:38:52.031855Z",
"structure_string": "Be1 Tl1 Cl1\n1.0\n5.169917 0.000000 0.000000\n-2.584958 4.477279 -0.000000\n0.000000 -0.000000 3.115813\nBe Tl Cl\n1 1 1\ndirect\n0.000000 0.000000 0.000000 Be\n0.666666 0.333333 0.000000 Tl\n0.333332 0.666666 0.000000 Cl\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Be",
"Tl",
"Cl"
],
"chemical_system": "Be-Cl-Tl",
"density": 5.729476987346949,
"density_atomic": 0.04159605471602734,
"volume": 72.12222458309424,
"volume_molar": 14.477672945457527,
"formula_full": "Be1 Tl1 Cl1",
"formula_reduced": "BeTlCl",
"formula_anonymous": "ABC",
"energy_above_hull": 0.5071742558333332,
"spacegroup": 187
},
{
"id": "jvasp-117668",
"created_at": "2022-09-04T14:38:52.229325Z",
"updated_at": "2022-09-04T14:38:52.229341Z",
"structure_string": "Be1 Tl1 Cl1\n1.0\n3.260792 -0.000000 -0.000000\n0.000000 3.260792 0.000000\n0.000000 -0.000000 7.998790\nBe Tl Cl\n1 1 1\ndirect\n0.000000 0.000000 0.465486 Be\n0.000000 0.000000 0.132280 Tl\n0.000000 0.000000 0.691794 Cl\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Be",
"Tl",
"Cl"
],
"chemical_system": "Be-Cl-Tl",
"density": 4.8586275078585235,
"density_atomic": 0.03527367962346273,
"volume": 85.04925009310661,
"volume_molar": 17.072618519771037,
"formula_full": "Be1 Tl1 Cl1",
"formula_reduced": "BeTlCl",
"formula_anonymous": "ABC",
"energy_above_hull": 0.3804375891666665,
"spacegroup": 99
},
{
"id": "jvasp-117670",
"created_at": "2022-09-04T14:38:36.466381Z",
"updated_at": "2022-09-04T14:38:36.466396Z",
"structure_string": "Be1 V1 Cl1\n1.0\n4.465644 0.726827 0.000000\n0.692346 4.484653 0.000000\n0.000000 0.000000 2.740198\nBe V Cl\n1 1 1\ndirect\n0.386861 0.013699 0.000000 Be\n-0.077780 -0.122999 0.000000 V\n-0.052926 0.373587 0.000000 Cl\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Be",
"V",
"Cl"
],
"chemical_system": "Be-Cl-V",
"density": 2.9613175199656854,
"density_atomic": 0.05607616963280517,
"volume": 53.49866118967169,
"volume_molar": 10.739215605191731,
"formula_full": "Be1 V1 Cl1",
"formula_reduced": "BeVCl",
"formula_anonymous": "ABC",
"energy_above_hull": 2.0274681225,
"spacegroup": 6
}
]
}