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=-formula_reduced&page=615",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-formula_reduced&page=613",
"results": [
{
"id": "jvasp-14932",
"created_at": "2022-09-04T14:36:06.943887Z",
"updated_at": "2022-09-04T14:36:06.943921Z",
"structure_string": "Ti4 B4\n1.0\n3.051427 0.000000 0.000000\n0.000000 4.569460 0.000000\n0.000000 0.000000 6.122341\nTi B\n4 4\ndirect\n0.250000 0.378627 0.676849 Ti\n0.750001 0.621373 0.323151 Ti\n0.750001 0.878627 0.823151 Ti\n0.250000 0.121373 0.176849 Ti\n0.250000 0.902224 0.529904 B\n0.750001 0.097776 0.470096 B\n0.750001 0.402224 0.970096 B\n0.250000 0.597776 0.029904 B\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Ti",
"B"
],
"chemical_system": "B-Ti",
"density": 4.565612113470088,
"density_atomic": 0.09371402846852164,
"volume": 85.36608798849346,
"volume_molar": 6.4260824749656615,
"formula_full": "Ti4 B4",
"formula_reduced": "TiB",
"formula_anonymous": "AB",
"energy_above_hull": 2.352550458333333,
"spacegroup": 62
},
{
"id": "jvasp-15899",
"created_at": "2022-09-04T14:38:31.921508Z",
"updated_at": "2022-09-04T14:38:31.921530Z",
"structure_string": "Ti1 B1\n1.0\n3.039626 -0.000000 1.754929\n1.013209 2.865788 1.754929\n-0.000000 -0.000000 3.509859\nTi B\n1 1\ndirect\n0.250000 0.250000 0.250000 Ti\n0.000000 0.000000 0.000000 B\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Ti",
"B"
],
"chemical_system": "B-Ti",
"density": 3.186915288816734,
"density_atomic": 0.06541481463609118,
"volume": 30.574114000417026,
"volume_molar": 9.206080906139901,
"formula_full": "Ti1 B1",
"formula_reduced": "TiB",
"formula_anonymous": "AB",
"energy_above_hull": 3.077340458333333,
"spacegroup": 216
},
{
"id": "jvasp-78754",
"created_at": "2022-09-04T14:37:01.720203Z",
"updated_at": "2022-09-04T14:37:01.720221Z",
"structure_string": "Ti1 Au1 Cl1\n1.0\n3.780736 0.000000 2.182810\n1.260245 3.564513 2.182810\n-0.000000 -0.000000 4.365619\nTi Au Cl\n1 1 1\ndirect\n0.000000 0.000000 0.000000 Ti\n0.500000 0.500000 0.500000 Au\n0.250000 0.250000 0.250000 Cl\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ti",
"Au",
"Cl"
],
"chemical_system": "Au-Cl-Ti",
"density": 7.91095653413936,
"density_atomic": 0.050991626870953606,
"volume": 58.833188585887065,
"volume_molar": 11.810058100794576,
"formula_full": "Ti1 Au1 Cl1",
"formula_reduced": "TiAuCl",
"formula_anonymous": "ABC",
"energy_above_hull": 1.358663323611111,
"spacegroup": 216
},
{
"id": "jvasp-16797",
"created_at": "2022-09-04T14:38:06.106951Z",
"updated_at": "2022-09-04T14:38:06.106974Z",
"structure_string": "Ti1 Au4\n1.0\n3.675877 0.000000 1.599779\n1.837939 4.645299 0.799889\n-0.015794 0.000000 5.059287\nTi Au\n1 4\ndirect\n0.000000 0.000000 0.000000 Ti\n0.605098 0.601660 0.188147 Au\n0.394904 0.398341 0.811854 Au\n0.793245 0.811853 0.601660 Au\n0.206758 0.188147 0.398341 Au\n",
"nsites": 5,
"nelements": 2,
"elements": [
"Ti",
"Au"
],
"chemical_system": "Au-Ti",
"density": 16.04217263929969,
"density_atomic": 0.05779847741964817,
"volume": 86.50746911025526,
"volume_molar": 10.41920311546618,
"formula_full": "Ti1 Au4",
"formula_reduced": "TiAu4",
"formula_anonymous": "AB4",
"energy_above_hull": 1.1204657226666668,
"spacegroup": 87
},
{
"id": "jvasp-102990",
"created_at": "2022-09-04T14:36:41.535512Z",
"updated_at": "2022-09-04T14:36:41.535521Z",
"structure_string": "Ti1 Au3\n1.0\n3.803685 -0.065607 -3.004859\n-0.932233 3.688260 -3.004859\n0.052002 0.065606 4.847112\nTi Au\n1 3\ndirect\n0.000000 0.000000 0.000000 Ti\n0.750001 0.250000 0.500000 Au\n0.250001 0.750000 0.500000 Au\n0.500001 0.500000 0.000000 Au\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ti",
"Au"
],
"chemical_system": "Au-Ti",
"density": 15.322727441001659,
"density_atomic": 0.05778361364016116,
"volume": 69.2237772616542,
"volume_molar": 10.421883265214225,
"formula_full": "Ti1 Au3",
"formula_reduced": "TiAu3",
"formula_anonymous": "AB3",
"energy_above_hull": 1.201075260833333,
"spacegroup": 139
},
{
"id": "jvasp-78509",
"created_at": "2022-09-04T14:36:37.990839Z",
"updated_at": "2022-09-04T14:36:37.990870Z",
"structure_string": "Ti1 Au2\n1.0\n3.460611 -0.000000 0.000000\n-0.000000 3.460611 0.000000\n-1.730306 -1.730306 4.289750\nTi Au\n1 2\ndirect\n0.500000 0.500000 -0.000000 Ti\n0.835969 0.835969 0.671941 Au\n0.164029 0.164029 0.328059 Au\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Ti",
"Au"
],
"chemical_system": "Au-Ti",
"density": 14.280302063286783,
"density_atomic": 0.05839608122767302,
"volume": 51.37331027922376,
"volume_molar": 10.312576860288013,
"formula_full": "Ti1 Au2",
"formula_reduced": "TiAu2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.233931157777778,
"spacegroup": 139
},
{
"id": "jvasp-35760",
"created_at": "2022-09-04T14:37:32.184256Z",
"updated_at": "2022-09-04T14:37:32.184291Z",
"structure_string": "Ti1 Au2\n1.0\n3.460545 0.000000 0.000000\n0.000000 3.460545 -0.000000\n-1.730273 -1.730273 4.289883\nTi Au\n1 2\ndirect\n0.000000 0.000000 0.000000 Ti\n0.664029 0.664029 0.328056 Au\n0.335973 0.335973 0.671943 Au\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Ti",
"Au"
],
"chemical_system": "Au-Ti",
"density": 14.28040402871825,
"density_atomic": 0.058396498192355706,
"volume": 51.372943461748704,
"volume_molar": 10.312503226072412,
"formula_full": "Ti1 Au2",
"formula_reduced": "TiAu2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.2339378244444443,
"spacegroup": 139
},
{
"id": "jvasp-37033",
"created_at": "2022-09-04T14:38:12.488328Z",
"updated_at": "2022-09-04T14:38:12.488347Z",
"structure_string": "Ti2 Au2\n1.0\n3.350382 0.000000 0.000000\n0.000000 3.350382 -0.000000\n0.000000 -0.000000 6.072822\nTi Au\n2 2\ndirect\n0.500000 0.000000 0.865137 Ti\n0.000000 0.500000 0.134863 Ti\n0.500000 0.000000 0.357809 Au\n0.000000 0.500000 0.642191 Au\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ti",
"Au"
],
"chemical_system": "Au-Ti",
"density": 11.928088462809523,
"density_atomic": 0.05867874085975097,
"volume": 68.1677885617973,
"volume_molar": 10.262900450426534,
"formula_full": "Ti2 Au2",
"formula_reduced": "TiAu",
"formula_anonymous": "AB",
"energy_above_hull": 1.1902129516666669,
"spacegroup": 129
},
{
"id": "jvasp-7702",
"created_at": "2022-09-04T14:37:06.857569Z",
"updated_at": "2022-09-04T14:37:06.857599Z",
"structure_string": "Ti1 Au1\n1.0\n3.263150 0.000000 -0.000000\n0.000000 3.263150 0.000000\n0.000000 -0.000000 3.263150\nTi Au\n1 1\ndirect\n0.500000 0.500000 0.500000 Ti\n0.000000 0.000000 0.000000 Au\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Ti",
"Au"
],
"chemical_system": "Au-Ti",
"density": 11.700621949995151,
"density_atomic": 0.0575597477703451,
"volume": 34.74650389330587,
"volume_molar": 10.462416868168798,
"formula_full": "Ti1 Au1",
"formula_reduced": "TiAu",
"formula_anonymous": "AB",
"energy_above_hull": 1.2471979516666667,
"spacegroup": 221
},
{
"id": "jvasp-37040",
"created_at": "2022-09-04T14:38:10.629094Z",
"updated_at": "2022-09-04T14:38:10.629120Z",
"structure_string": "Ti2 Au2\n1.0\n2.996381 0.000000 0.000000\n0.000000 4.613892 -0.000000\n0.000000 -0.000000 4.913190\nTi Au\n2 2\ndirect\n0.000000 0.750000 0.313059 Ti\n0.000000 0.250000 0.686941 Ti\n0.500000 0.750000 0.817672 Au\n0.500000 0.250000 0.182328 Au\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ti",
"Au"
],
"chemical_system": "Au-Ti",
"density": 11.970768667826984,
"density_atomic": 0.05888870079573479,
"volume": 67.9247452558796,
"volume_molar": 10.226309425451229,
"formula_full": "Ti2 Au2",
"formula_reduced": "TiAu",
"formula_anonymous": "AB",
"energy_above_hull": 1.213232951666667,
"spacegroup": 51
},
{
"id": "jvasp-75856",
"created_at": "2022-09-04T14:36:06.613814Z",
"updated_at": "2022-09-04T14:36:06.613840Z",
"structure_string": "Ti1 As1 W2\n1.0\n0.000000 3.164568 3.164568\n3.164568 0.000000 3.164568\n3.164568 3.164568 -0.000000\nTi As W\n1 1 2\ndirect\n0.250000 0.250000 0.250000 Ti\n0.500000 0.500000 0.500000 As\n0.000000 0.000000 0.000000 W\n0.750000 0.750000 0.750000 W\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ti",
"As",
"W"
],
"chemical_system": "As-Ti-W",
"density": 12.849523237166208,
"density_atomic": 0.06310833163211443,
"volume": 63.383073146628526,
"volume_molar": 9.542544707259328,
"formula_full": "Ti1 As1 W2",
"formula_reduced": "TiAsW2",
"formula_anonymous": "ABC2",
"energy_above_hull": 5.522087520833333,
"spacegroup": 216
},
{
"id": "jvasp-75533",
"created_at": "2022-09-04T14:36:06.134497Z",
"updated_at": "2022-09-04T14:36:06.134521Z",
"structure_string": "Ti1 As1 Se1\n1.0\n-0.000000 3.143705 3.143705\n3.143705 0.000000 3.143705\n3.143705 3.143705 0.000000\nTi As Se\n1 1 1\ndirect\n0.000000 0.000000 0.000000 Ti\n0.499999 0.499999 0.499999 As\n0.250000 0.250000 0.250000 Se\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ti",
"As",
"Se"
],
"chemical_system": "As-Se-Ti",
"density": 5.391433763500965,
"density_atomic": 0.04827984883152537,
"volume": 62.13772562686827,
"volume_molar": 12.473404341041999,
"formula_full": "Ti1 As1 Se1",
"formula_reduced": "TiAsSe",
"formula_anonymous": "ABC",
"energy_above_hull": 2.2636744833333333,
"spacegroup": 216
}
]
}