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_full&page=1568",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-formula_full&page=1566",
"results": [
{
"id": "jvasp-79904",
"created_at": "2022-09-04T14:37:12.761761Z",
"updated_at": "2022-09-04T14:37:12.761781Z",
"structure_string": "Pa1 Al1 Au2\n1.0\n0.000000 3.455046 3.455046\n3.455046 0.000000 3.455046\n3.455046 3.455046 0.000000\nPa Al Au\n1 1 2\ndirect\n0.750001 0.750001 0.750001 Pa\n0.250000 0.250000 0.250000 Al\n0.000000 0.000000 0.000000 Au\n0.500001 0.500001 0.500001 Au\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Pa",
"Al",
"Au"
],
"chemical_system": "Al-Au-Pa",
"density": 13.124182490734551,
"density_atomic": 0.04849182107221405,
"volume": 82.48813741276487,
"volume_molar": 12.418879363247306,
"formula_full": "Pa1 Al1 Au2",
"formula_reduced": "PaAlAu2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.7096352600000002,
"spacegroup": 225
},
{
"id": "jvasp-123348",
"created_at": "2022-09-04T14:38:50.337767Z",
"updated_at": "2022-09-04T14:38:50.337795Z",
"structure_string": "Pa1 Ag3\n1.0\n4.454664 0.000000 0.000000\n0.000000 4.454664 -0.000000\n0.000000 -0.000000 4.454664\nPa Ag\n1 3\ndirect\n0.000000 0.000000 0.000000 Pa\n0.000000 0.500000 0.500000 Ag\n0.500000 0.000000 0.500000 Ag\n0.500000 0.500000 0.000000 Ag\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Pa",
"Ag"
],
"chemical_system": "Ag-Pa",
"density": 10.418754474872811,
"density_atomic": 0.04524964064162548,
"volume": 88.39849208261712,
"volume_molar": 13.308704057331648,
"formula_full": "Pa1 Ag3",
"formula_reduced": "PaAg3",
"formula_anonymous": "AB3",
"energy_above_hull": 1.09018622,
"spacegroup": 221
},
{
"id": "jvasp-41110",
"created_at": "2022-09-04T14:38:03.733154Z",
"updated_at": "2022-09-04T14:38:03.733192Z",
"structure_string": "Pa1 Ag1 Te2\n1.0\n0.000003 3.721256 3.721265\n3.721248 0.000002 3.721266\n3.721251 3.721259 -0.000001\nPa Ag Te\n1 1 2\ndirect\n0.750002 0.750001 0.749999 Pa\n0.250001 0.250001 0.250001 Ag\n0.000001 -0.000000 0.000000 Te\n0.500001 0.499999 0.499999 Te\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Pa",
"Ag",
"Te"
],
"chemical_system": "Ag-Pa-Te",
"density": 9.57222065530106,
"density_atomic": 0.03881155651509641,
"volume": 103.06208663504987,
"volume_molar": 15.516359818389626,
"formula_full": "Pa1 Ag1 Te2",
"formula_reduced": "PaAgTe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.4822414733333331,
"spacegroup": 225
},
{
"id": "jvasp-38840",
"created_at": "2022-09-04T14:37:50.512700Z",
"updated_at": "2022-09-04T14:37:50.512723Z",
"structure_string": "Pa1 Ag1 O3\n1.0\n4.342251 -0.000000 -0.000000\n-0.000000 4.342251 0.000000\n0.000000 0.000000 4.342251\nPa Ag O\n1 1 3\ndirect\n0.500000 0.500000 0.500000 Pa\n0.000000 0.000000 0.000000 Ag\n0.500000 0.500000 0.000000 O\n0.500000 0.000000 0.500000 O\n0.000000 0.500000 0.500000 O\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Pa",
"Ag",
"O"
],
"chemical_system": "Ag-O-Pa",
"density": 7.847035455692468,
"density_atomic": 0.0610696221268345,
"volume": 81.87376679055885,
"volume_molar": 9.861106963283175,
"formula_full": "Pa1 Ag1 O3",
"formula_reduced": "PaAgO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.984292172,
"spacegroup": 221
},
{
"id": "jvasp-38835",
"created_at": "2022-09-04T14:37:57.342112Z",
"updated_at": "2022-09-04T14:37:57.342136Z",
"structure_string": "Pa1 Ag1 Au2\n1.0\n0.000050 3.463447 3.463447\n3.463447 0.000050 3.463447\n3.463447 3.463447 0.000050\nPa Ag Au\n1 1 2\ndirect\n0.749999 0.749999 0.749999 Pa\n0.250001 0.250001 0.250001 Ag\n-0.000001 -0.000001 -0.000001 Au\n0.500001 0.500001 0.500001 Au\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Pa",
"Ag",
"Au"
],
"chemical_system": "Ag-Au-Pa",
"density": 14.645708479913562,
"density_atomic": 0.04814085085206173,
"volume": 83.08951605969987,
"volume_molar": 12.509419034794831,
"formula_full": "Pa1 Ag1 Au2",
"formula_reduced": "PaAgAu2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.2523913750000002,
"spacegroup": 225
},
{
"id": "jvasp-16330",
"created_at": "2022-09-04T14:37:50.250779Z",
"updated_at": "2022-09-04T14:37:50.250806Z",
"structure_string": "Pa1\n1.0\n2.879607 -0.000000 1.662542\n0.959869 2.714920 1.662542\n0.000000 0.000000 3.325083\nPa\n1\ndirect\n0.000000 0.000000 0.000000 Pa\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Pa"
],
"chemical_system": "Pa",
"density": 14.758281191869,
"density_atomic": 0.03846867713526119,
"volume": 25.995175152081824,
"volume_molar": 15.654660384669118,
"formula_full": "Pa1",
"formula_reduced": "Pa",
"formula_anonymous": "A",
"energy_above_hull": 0.0908699999999997,
"spacegroup": 225
},
{
"id": "jvasp-25284",
"created_at": "2022-09-04T14:37:45.303813Z",
"updated_at": "2022-09-04T14:37:45.303836Z",
"structure_string": "Pa1\n1.0\n3.132700 -0.019804 -0.809437\n-1.882932 2.503751 -0.809437\n0.009964 0.019804 3.235568\nPa\n1\ndirect\n0.000000 0.000000 0.000000 Pa\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Pa"
],
"chemical_system": "Pa",
"density": 15.12894750844211,
"density_atomic": 0.03943484946060105,
"volume": 25.35828115685061,
"volume_molar": 15.271113855821001,
"formula_full": "Pa1",
"formula_reduced": "Pa",
"formula_anonymous": "A",
"energy_above_hull": 0.1115300000000001,
"spacegroup": 139
},
{
"id": "jvasp-958",
"created_at": "2022-09-04T14:37:49.321998Z",
"updated_at": "2022-09-04T14:37:49.322021Z",
"structure_string": "Pa1\n1.0\n2.879576 -0.000000 1.662524\n0.959858 2.714890 1.662524\n-0.000000 -0.000000 3.325048\nPa\n1\ndirect\n0.000000 -0.000000 -0.000000 Pa\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Pa"
],
"chemical_system": "Pa",
"density": 14.758758506526647,
"density_atomic": 0.0384699212952835,
"volume": 25.994334439218157,
"volume_molar": 15.654154095548739,
"formula_full": "Pa1",
"formula_reduced": "Pa",
"formula_anonymous": "A",
"energy_above_hull": 0.0908600000000001,
"spacegroup": 225
},
{
"id": "jvasp-14807",
"created_at": "2022-09-04T14:36:16.643802Z",
"updated_at": "2022-09-04T14:36:16.643828Z",
"structure_string": "Pa1\n1.0\n3.132707 -0.019805 -0.809439\n-1.882938 2.503756 -0.809439\n0.009964 0.019805 3.235575\nPa\n1\ndirect\n0.000000 0.000000 0.000000 Pa\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Pa"
],
"chemical_system": "Pa",
"density": 15.128851980043246,
"density_atomic": 0.039434600457950574,
"volume": 25.358441277129405,
"volume_molar": 15.271210282506743,
"formula_full": "Pa1",
"formula_reduced": "Pa",
"formula_anonymous": "A",
"energy_above_hull": 0.1115399999999997,
"spacegroup": 139
},
{
"id": "jvasp-58924",
"created_at": "2022-09-04T14:37:03.299280Z",
"updated_at": "2022-09-04T14:37:03.299302Z",
"structure_string": "P8 Se20\n1.0\n0.000000 5.759207 0.007654\n20.371851 0.000000 0.000000\n0.000000 -2.789415 -6.420276\nP Se\n8 20\ndirect\n0.727064 0.666108 0.731745 P\n0.772938 0.166108 0.268257 P\n0.272938 0.333892 0.268256 P\n0.227064 0.833892 0.731745 P\n0.298833 0.545906 0.723934 P\n0.201169 0.045906 0.276067 P\n0.701169 0.454094 0.276067 P\n0.798833 0.954094 0.723935 P\n0.844292 0.895066 0.015024 Se\n0.634245 0.692429 0.012433 Se\n0.865758 0.192429 0.987569 Se\n0.800616 0.053197 0.267733 Se\n0.134244 0.807571 0.012432 Se\n0.699386 0.553197 0.732269 Se\n0.655711 0.395066 0.984978 Se\n0.365757 0.307571 0.987569 Se\n0.155710 0.104934 0.984978 Se\n0.430891 0.106621 0.565369 Se\n0.569111 0.893379 0.434632 Se\n0.930891 0.393379 0.565370 Se\n0.300616 0.446803 0.267732 Se\n0.069111 0.606621 0.434632 Se\n0.867133 0.806784 0.445300 Se\n0.632869 0.306784 0.554702 Se\n0.132869 0.193216 0.554702 Se\n0.367133 0.693216 0.445299 Se\n0.344291 0.604934 0.015023 Se\n0.199386 0.946803 0.732269 Se\n",
"nsites": 28,
"nelements": 2,
"elements": [
"P",
"Se"
],
"chemical_system": "P-Se",
"density": 4.029853439396862,
"density_atomic": 0.037193067003518696,
"volume": 752.828477343668,
"volume_molar": 16.19156806678586,
"formula_full": "P8 Se20",
"formula_reduced": "P2Se5",
"formula_anonymous": "A2B5",
"energy_above_hull": 2.1052196904761904,
"spacegroup": 14
},
{
"id": "jvasp-5590",
"created_at": "2022-09-04T14:38:16.898207Z",
"updated_at": "2022-09-04T14:38:16.898221Z",
"structure_string": "P8 Se20\n1.0\n0.000000 5.759144 0.008214\n20.376477 0.000000 0.000000\n0.000000 -2.790013 -6.420013\nP Se\n8 20\ndirect\n0.727105 0.666114 0.731653 P\n0.772894 0.166114 0.268347 P\n0.272894 0.333886 0.268347 P\n0.227106 0.833886 0.731653 P\n0.298962 0.545910 0.723889 P\n0.201038 0.045909 0.276111 P\n0.701037 0.454091 0.276111 P\n0.798962 0.954091 0.723889 P\n0.844424 0.895053 0.014948 Se\n0.634378 0.692426 0.012390 Se\n0.865621 0.192426 -0.012390 Se\n0.800487 0.053225 0.267791 Se\n0.134378 0.807574 0.012390 Se\n0.699513 0.553225 0.732210 Se\n0.655576 0.395053 -0.014947 Se\n0.365621 0.307574 -0.012390 Se\n0.155576 0.104947 -0.014947 Se\n0.430900 0.106584 0.565492 Se\n0.569100 0.893416 0.434508 Se\n0.930900 0.393416 0.565492 Se\n0.300487 0.446775 0.267791 Se\n0.069100 0.606584 0.434508 Se\n0.867014 0.806804 0.445220 Se\n0.632985 0.306804 0.554781 Se\n0.132986 0.193196 0.554780 Se\n0.367015 0.693197 0.445220 Se\n0.344424 0.604947 0.014948 Se\n0.199513 0.946776 0.732209 Se\n",
"nsites": 28,
"nelements": 2,
"elements": [
"P",
"Se"
],
"chemical_system": "P-Se",
"density": 4.029318664774981,
"density_atomic": 0.0371881313628949,
"volume": 752.9283933835268,
"volume_molar": 16.19371702555804,
"formula_full": "P8 Se20",
"formula_reduced": "P2Se5",
"formula_anonymous": "A2B5",
"energy_above_hull": 2.105202547619048,
"spacegroup": 14
},
{
"id": "jvasp-4313",
"created_at": "2022-09-04T14:36:58.880824Z",
"updated_at": "2022-09-04T14:36:58.880847Z",
"structure_string": "P8 S8\n1.0\n6.538159 0.031892 1.093230\n0.373703 6.527549 1.093230\n0.021181 0.020101 8.781711\nP S\n8 8\ndirect\n0.197940 0.793834 0.436485 P\n0.206165 0.802060 0.063515 P\n0.802060 0.206165 0.563515 P\n0.793834 0.197940 0.936485 P\n0.547396 0.761987 0.130276 P\n0.238012 0.452604 0.369724 P\n0.452604 0.238012 0.869724 P\n0.761987 0.547396 0.630276 P\n0.547208 0.452792 0.250000 S\n0.452791 0.547208 0.750000 S\n0.048133 0.951867 0.250000 S\n0.951867 0.048133 0.750000 S\n0.494556 0.898576 0.337237 S\n0.101424 0.505444 0.162763 S\n0.505444 0.101424 0.662763 S\n0.898576 0.494556 0.837237 S\n",
"nsites": 16,
"nelements": 2,
"elements": [
"P",
"S"
],
"chemical_system": "P-S",
"density": 2.236736279438945,
"density_atomic": 0.04273542276237895,
"volume": 374.3966706253155,
"volume_molar": 14.091684066131295,
"formula_full": "P8 S8",
"formula_reduced": "PS",
"formula_anonymous": "AB",
"energy_above_hull": 1.54301275,
"spacegroup": 15
}
]
}