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=3485",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-formula_full&page=3483",
"results": [
{
"id": "jvasp-87964",
"created_at": "2022-09-04T14:36:15.608794Z",
"updated_at": "2022-09-04T14:36:15.608815Z",
"structure_string": "Cu4 N12\n1.0\n5.332220 0.000000 2.437523\n2.666114 5.998961 1.218753\n0.172036 0.000010 6.674688\nCu N\n4 12\ndirect\n0.500000 0.500000 0.500000 Cu\n0.000000 0.000000 0.500000 Cu\n0.500000 0.500000 -0.000000 Cu\n0.500000 -0.000000 -0.000000 Cu\n0.811012 0.451127 0.548896 N\n0.359908 0.951103 0.451126 N\n0.762138 0.548896 0.048873 N\n0.811036 0.048873 0.951103 N\n0.000000 0.000000 0.000000 N\n-0.000000 0.500000 -0.000000 N\n0.500000 0.000000 0.500000 N\n0.000000 0.500000 0.500000 N\n0.188965 0.951127 0.048896 N\n0.237862 0.451104 0.951127 N\n0.640092 0.048896 0.548873 N\n0.188988 0.548873 0.451103 N\n",
"nsites": 16,
"nelements": 2,
"elements": [
"Cu",
"N"
],
"chemical_system": "Cu-N",
"density": 3.323271762640072,
"density_atomic": 0.0758319587264016,
"volume": 210.99283558963975,
"volume_molar": 7.941428470452176,
"formula_full": "Cu4 N12",
"formula_reduced": "CuN3",
"formula_anonymous": "AB3",
"energy_above_hull": 3.89457505,
"spacegroup": 141
},
{
"id": "jvasp-85247",
"created_at": "2022-09-04T14:37:11.464769Z",
"updated_at": "2022-09-04T14:37:11.464793Z",
"structure_string": "Cu4 Mo6 Se8\n1.0\n6.602197 -0.036484 1.913783\n-0.049857 6.571924 2.094753\n-0.158853 -0.228898 8.051405\nCu Mo Se\n4 6 8\ndirect\n0.269755 0.142951 0.014440 Cu\n0.730245 0.857049 0.985559 Cu\n0.642490 0.231034 0.918968 Cu\n0.357510 0.768966 0.081031 Cu\n0.222824 0.925962 0.579760 Mo\n0.777176 0.074037 0.420239 Mo\n0.425214 0.277800 0.455543 Mo\n0.501279 0.001895 0.264402 Mo\n0.574786 0.722199 0.544456 Mo\n0.498721 0.998105 0.735597 Mo\n0.149347 0.197179 0.753272 Se\n0.838879 0.787704 0.700956 Se\n0.696764 0.352987 0.154576 Se\n0.290691 0.662460 0.398661 Se\n0.303237 0.647013 0.845423 Se\n0.850653 0.802821 0.246727 Se\n0.161121 0.212296 0.299043 Se\n0.709309 0.337539 0.601338 Se\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Cu",
"Mo",
"Se"
],
"chemical_system": "Cu-Mo-Se",
"density": 6.8454260543094465,
"density_atomic": 0.0507719545727171,
"volume": 354.5264339630626,
"volume_molar": 11.861156047035598,
"formula_full": "Cu4 Mo6 Se8",
"formula_reduced": "Cu2Mo3Se4",
"formula_anonymous": "A2B3C4",
"energy_above_hull": 2.938741340740741,
"spacegroup": 2
},
{
"id": "jvasp-92236",
"created_at": "2022-09-04T14:36:16.394705Z",
"updated_at": "2022-09-04T14:36:16.394718Z",
"structure_string": "Cu4 I4\n1.0\n3.503002 0.000000 2.477394\n-0.000314 8.580513 14.865305\n-0.000157 0.000000 7.432653\nCu I\n4 4\ndirect\n0.805091 0.000046 0.731586 Cu\n0.805092 0.249954 0.731769 Cu\n0.804374 0.499940 0.731980 Cu\n0.804374 0.750060 0.731738 Cu\n0.054887 -0.000022 0.981765 I\n0.054887 0.250022 0.981675 I\n0.054346 0.500022 0.981798 I\n0.054346 0.749977 0.981889 I\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Cu",
"I"
],
"chemical_system": "Cu-I",
"density": 5.66222539300996,
"density_atomic": 0.03580848957037081,
"volume": 223.4107077953793,
"volume_molar": 16.817634120437543,
"formula_full": "Cu4 I4",
"formula_reduced": "CuI",
"formula_anonymous": "AB",
"energy_above_hull": 0.0,
"spacegroup": 216
},
{
"id": "jvasp-8759",
"created_at": "2022-09-04T14:36:33.244421Z",
"updated_at": "2022-09-04T14:36:33.244449Z",
"structure_string": "Cu4 I4\n1.0\n14.290092 0.005089 0.002983\n13.647199 4.238009 0.002983\n13.647199 2.072728 3.696556\nCu I\n4 4\ndirect\n0.270272 0.270272 0.270272 Cu\n0.437431 0.437432 0.437431 Cu\n0.687068 0.687069 0.687068 Cu\n0.853973 0.853975 0.853973 Cu\n0.208256 0.208257 0.208256 I\n0.375103 0.375104 0.375103 I\n0.624873 0.624874 0.624873 I\n0.791823 0.791824 0.791823 I\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Cu",
"I"
],
"chemical_system": "Cu-I",
"density": 5.661582038673415,
"density_atomic": 0.03580442093207911,
"volume": 223.43609508937396,
"volume_molar": 16.819545193661934,
"formula_full": "Cu4 I4",
"formula_reduced": "CuI",
"formula_anonymous": "AB",
"energy_above_hull": 0.0008299999999999,
"spacegroup": 160
},
{
"id": "jvasp-102773",
"created_at": "2022-09-04T14:36:48.992367Z",
"updated_at": "2022-09-04T14:36:48.992394Z",
"structure_string": "Cu4 I3 Cl1\n1.0\n3.967177 -0.000000 0.000000\n0.000000 5.569594 0.000000\n-0.000000 0.000000 7.915787\nCu I Cl\n4 3 1\ndirect\n0.000000 0.000000 0.500000 Cu\n0.500000 0.500000 0.770485 Cu\n0.000000 0.000000 0.000000 Cu\n0.500000 0.500000 0.229516 Cu\n0.500000 0.000000 0.240258 I\n-0.000000 0.500000 0.500000 I\n0.500000 0.000000 0.759742 I\n-0.000000 0.500000 -0.000000 Cl\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Cu",
"I",
"Cl"
],
"chemical_system": "Cl-Cu-I",
"density": 6.364316390797854,
"density_atomic": 0.04573943249746624,
"volume": 174.9037878955574,
"volume_molar": 13.166190377052885,
"formula_full": "Cu4 I3 Cl1",
"formula_reduced": "Cu4I3Cl",
"formula_anonymous": "AB3C4",
"energy_above_hull": 0.0,
"spacegroup": 47
},
{
"id": "jvasp-29594",
"created_at": "2022-09-04T14:37:05.549167Z",
"updated_at": "2022-09-04T14:37:05.549191Z",
"structure_string": "Cu4 Hg4 Se4 Cl4\n1.0\n4.230120 0.000000 0.000000\n0.000000 7.214025 0.000000\n0.000000 0.000000 12.847759\nCu Hg Se Cl\n4 4 4 4\ndirect\n0.500000 0.804924 0.473292 Cu\n0.500000 0.304925 0.026708 Cu\n0.500000 0.195075 0.526708 Cu\n0.500000 0.695075 0.973292 Cu\n0.000000 0.589312 0.250649 Hg\n0.000000 0.089312 0.249351 Hg\n0.000000 0.410687 0.749351 Hg\n0.000000 0.910687 0.750649 Hg\n0.000000 0.840458 0.391420 Se\n0.000000 0.659541 0.891420 Se\n0.000000 0.159541 0.608580 Se\n0.000000 0.340458 0.108580 Se\n0.500000 0.835791 0.128804 Cl\n0.500000 0.335791 0.371196 Cl\n0.500000 0.164209 0.871196 Cl\n0.500000 0.664208 0.628804 Cl\n",
"nsites": 16,
"nelements": 4,
"elements": [
"Cu",
"Hg",
"Se",
"Cl"
],
"chemical_system": "Cl-Cu-Hg-Se",
"density": 6.413180744957963,
"density_atomic": 0.04080959366296584,
"volume": 392.0646731290487,
"volume_molar": 14.756679053790757,
"formula_full": "Cu4 Hg4 Se4 Cl4",
"formula_reduced": "CuHgSeCl",
"formula_anonymous": "ABCD",
"energy_above_hull": 0.0,
"spacegroup": 55
},
{
"id": "jvasp-60706",
"created_at": "2022-09-04T14:36:21.801213Z",
"updated_at": "2022-09-04T14:36:21.801234Z",
"structure_string": "Cu4 Hg4 Se4 Br4\n1.0\n4.328943 0.000000 0.000000\n0.000000 9.806193 0.000000\n0.000000 -0.000000 10.036397\nCu Hg Se Br\n4 4 4 4\ndirect\n0.000000 0.216396 0.107811 Cu\n0.000000 0.216396 0.392189 Cu\n0.000000 0.783603 0.607811 Cu\n0.000000 0.783603 0.892189 Cu\n0.500000 0.784143 0.250000 Hg\n0.500000 0.500000 0.500000 Hg\n0.500000 0.215857 0.750000 Hg\n0.500000 0.500000 0.000000 Hg\n0.500000 0.759412 0.503833 Se\n0.500000 0.240587 0.496167 Se\n0.500000 0.759412 -0.003833 Se\n0.500000 0.240587 0.003833 Se\n0.000000 0.987624 0.750000 Br\n0.000000 0.012375 0.250000 Br\n0.000000 0.553478 0.750000 Br\n0.000000 0.446522 0.250000 Br\n",
"nsites": 16,
"nelements": 4,
"elements": [
"Cu",
"Hg",
"Se",
"Br"
],
"chemical_system": "Br-Cu-Hg-Se",
"density": 6.594613089476127,
"density_atomic": 0.03755431517379472,
"volume": 426.0495744884399,
"volume_molar": 16.03581567692181,
"formula_full": "Cu4 Hg4 Se4 Br4",
"formula_reduced": "CuHgSeBr",
"formula_anonymous": "ABCD",
"energy_above_hull": 0.0,
"spacegroup": 51
},
{
"id": "jvasp-97402",
"created_at": "2022-09-04T14:36:20.145179Z",
"updated_at": "2022-09-04T14:36:20.145201Z",
"structure_string": "Cu4 Hg4 S4 I4\n1.0\n7.062357 0.000000 0.000000\n0.000000 7.182381 0.000000\n0.000000 0.000000 8.471726\nCu Hg S I\n4 4 4 4\ndirect\n0.293368 0.077102 0.357037 Cu\n0.793368 0.922898 0.642963 Cu\n0.793368 0.422898 0.857037 Cu\n0.293368 0.577102 0.142963 Cu\n0.189346 0.032831 0.946766 Hg\n0.689346 0.967169 0.053235 Hg\n0.689346 0.467169 0.446766 Hg\n0.189346 0.532831 0.553235 Hg\n0.875399 0.117521 0.841696 S\n0.375398 0.882479 0.158305 S\n0.375398 0.382479 0.341696 S\n0.875399 0.617521 0.658305 S\n0.408358 0.915633 0.624247 I\n0.908358 0.084367 0.375754 I\n0.908358 0.584367 0.124246 I\n0.408358 0.415633 0.875754 I\n",
"nsites": 16,
"nelements": 4,
"elements": [
"Cu",
"Hg",
"S",
"I"
],
"chemical_system": "Cu-Hg-I-S",
"density": 6.539849007112141,
"density_atomic": 0.03723316674075217,
"volume": 429.7243936140355,
"volume_molar": 16.174129914683544,
"formula_full": "Cu4 Hg4 S4 I4",
"formula_reduced": "CuHgSI",
"formula_anonymous": "ABCD",
"energy_above_hull": 0.0,
"spacegroup": 33
},
{
"id": "jvasp-95425",
"created_at": "2022-09-04T14:36:11.599468Z",
"updated_at": "2022-09-04T14:36:11.599485Z",
"structure_string": "Cu4 Hg4 S4 I4\n1.0\n7.059173 0.000000 0.000000\n0.000000 7.180392 0.000000\n0.000000 0.000000 8.472455\nCu Hg S I\n4 4 4 4\ndirect\n0.294858 0.077080 0.359222 Cu\n0.794858 0.922920 0.640777 Cu\n0.794858 0.422920 0.859222 Cu\n0.294858 0.577080 0.140778 Cu\n0.185285 0.030261 0.951850 Hg\n0.685284 0.969738 0.048149 Hg\n0.685284 0.469739 0.451851 Hg\n0.185285 0.530261 0.548149 Hg\n0.877316 0.116756 0.841432 S\n0.377316 0.883243 0.158568 S\n0.377316 0.383243 0.341432 S\n0.877316 0.616756 0.658567 S\n0.409011 0.914300 0.625183 I\n0.909010 0.085700 0.374816 I\n0.909010 0.585700 0.125183 I\n0.409011 0.414300 0.874816 I\n",
"nsites": 16,
"nelements": 4,
"elements": [
"Cu",
"Hg",
"S",
"I"
],
"chemical_system": "Cu-Hg-I-S",
"density": 6.544048031356332,
"density_atomic": 0.03725707294556858,
"volume": 429.448658604381,
"volume_molar": 16.1637516956798,
"formula_full": "Cu4 Hg4 S4 I4",
"formula_reduced": "CuHgSI",
"formula_anonymous": "ABCD",
"energy_above_hull": 0.0039875,
"spacegroup": 33
},
{
"id": "jvasp-34458",
"created_at": "2022-09-04T14:37:16.007207Z",
"updated_at": "2022-09-04T14:37:16.007234Z",
"structure_string": "Cu4 Hg4 S4 Br4\n1.0\n4.099026 0.000000 0.000000\n0.000000 9.466352 -0.000000\n0.000000 -0.000000 10.105669\nCu Hg S Br\n4 4 4 4\ndirect\n0.000000 0.202209 0.075239 Cu\n0.000000 0.202209 0.424761 Cu\n0.000000 0.797790 0.575239 Cu\n0.000000 0.797790 0.924762 Cu\n0.500000 0.775198 0.250000 Hg\n0.500000 0.224801 0.750000 Hg\n0.500000 0.500000 0.500000 Hg\n0.500000 0.500000 0.000000 Hg\n0.500000 0.243206 0.990430 S\n0.500000 0.243206 0.509570 S\n0.500000 0.756794 0.009570 S\n0.500000 0.756794 0.490430 S\n0.000000 0.550183 0.750000 Br\n0.000000 0.449817 0.250000 Br\n0.000000 0.976729 0.750000 Br\n0.000000 0.023271 0.250000 Br\n",
"nsites": 16,
"nelements": 4,
"elements": [
"Cu",
"Hg",
"S",
"Br"
],
"chemical_system": "Br-Cu-Hg-S",
"density": 6.370738869160806,
"density_atomic": 0.04080295261009333,
"volume": 392.12848523227007,
"volume_molar": 14.759080837964449,
"formula_full": "Cu4 Hg4 S4 Br4",
"formula_reduced": "CuHgSBr",
"formula_anonymous": "ABCD",
"energy_above_hull": 0.0,
"spacegroup": 51
},
{
"id": "jvasp-21439",
"created_at": "2022-09-04T14:37:05.755326Z",
"updated_at": "2022-09-04T14:37:05.755347Z",
"structure_string": "Cu4 Hg4 S2 F12\n1.0\n6.645107 -0.000000 3.836554\n2.215035 6.265067 3.836554\n-0.000000 -0.000000 7.673108\nCu Hg S F\n4 4 2 12\ndirect\n0.000000 0.000000 0.000000 Cu\n0.000000 0.000000 0.500000 Cu\n0.500000 0.000000 -0.000000 Cu\n0.000000 0.500000 -0.000001 Cu\n0.500001 0.500000 0.499999 Hg\n0.000000 0.500000 0.500000 Hg\n0.500000 0.000000 0.500000 Hg\n0.500001 0.500000 -0.000001 Hg\n0.625001 0.625000 0.624999 S\n0.375000 0.375000 0.374999 S\n0.318183 0.318183 0.931817 F\n0.681818 0.068183 0.068182 F\n0.931818 0.318183 0.318182 F\n0.318183 0.931818 0.318182 F\n0.068183 0.681818 0.068182 F\n0.931818 0.931818 0.318181 F\n0.931818 0.318183 0.931816 F\n0.068183 0.681818 0.681817 F\n0.318183 0.931818 0.931816 F\n0.681818 0.068183 0.681817 F\n0.681818 0.681818 0.068181 F\n0.068183 0.068183 0.681817 F\n",
"nsites": 22,
"nelements": 4,
"elements": [
"Cu",
"Hg",
"S",
"F"
],
"chemical_system": "Cu-F-Hg-S",
"density": 7.010530822787467,
"density_atomic": 0.06886898330488053,
"volume": 319.4471436090001,
"volume_molar": 8.744343928151514,
"formula_full": "Cu4 Hg4 S2 F12",
"formula_reduced": "Cu2Hg2SF6",
"formula_anonymous": "AB2C2D6",
"energy_above_hull": 0.0,
"spacegroup": 227
},
{
"id": "jvasp-29951",
"created_at": "2022-09-04T14:38:31.511013Z",
"updated_at": "2022-09-04T14:38:31.511038Z",
"structure_string": "Cu4 Hg2 I8\n1.0\n8.346353 0.000000 0.000000\n-4.173177 4.026423 0.000000\n0.000000 0.000000 15.757400\nCu Hg I\n4 2 8\ndirect\n0.500000 -0.000000 0.500000 Cu\n0.499999 0.500000 0.500000 Cu\n0.500000 -0.000000 0.000000 Cu\n-0.000000 0.500000 0.000000 Cu\n0.499999 0.500000 0.000000 Hg\n-0.000000 0.500000 0.500000 Hg\n0.230129 0.508428 0.124057 I\n0.278297 0.508428 0.624057 I\n0.278297 0.508428 0.375943 I\n0.230129 0.508428 0.875943 I\n0.769870 0.491571 0.124057 I\n0.721701 0.491571 0.375943 I\n0.721701 0.491571 0.624057 I\n0.769870 0.491571 0.875943 I\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Cu",
"Hg",
"I"
],
"chemical_system": "Cu-Hg-I",
"density": 5.238667149944031,
"density_atomic": 0.026437922734835428,
"volume": 529.5423600566456,
"volume_molar": 22.7784187903123,
"formula_full": "Cu4 Hg2 I8",
"formula_reduced": "Cu2HgI4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 0.0381514285714285,
"spacegroup": 66
}
]
}