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_anonymous&page=179",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=formula_anonymous&page=177",
"results": [
{
"id": "jvasp-50017",
"created_at": "2022-09-04T14:37:08.177967Z",
"updated_at": "2022-09-04T14:37:08.177987Z",
"structure_string": "Ti6 N4 O6\n1.0\n-0.000000 3.766254 0.000000\n-4.959501 1.883127 0.000000\n0.000000 -0.000000 10.026242\nTi N O\n6 4 6\ndirect\n0.133466 0.733068 0.941409 Ti\n0.134918 0.730165 0.550857 Ti\n0.195371 0.609260 0.245988 Ti\n0.804629 0.390740 0.745988 Ti\n0.865082 0.269835 0.050857 Ti\n0.866534 0.266931 0.441409 Ti\n0.046724 0.906554 0.382246 N\n0.696652 0.606693 0.576407 N\n0.303348 0.393307 0.076407 N\n0.953276 0.093445 0.882246 N\n0.045163 0.909676 0.119684 O\n0.685320 0.629360 0.922727 O\n0.754443 0.491114 0.260681 O\n0.245557 0.508886 0.760681 O\n0.314680 0.370640 0.422727 O\n0.954836 0.090324 0.619684 O\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Ti",
"N",
"O"
],
"chemical_system": "N-O-Ti",
"density": 3.894489845618489,
"density_atomic": 0.08543468287998093,
"volume": 187.27757230019662,
"volume_molar": 7.048824384892882,
"formula_full": "Ti6 N4 O6",
"formula_reduced": "Ti3N2O3",
"formula_anonymous": "A2B3C3",
"energy_above_hull": 3.9159865,
"spacegroup": 36
},
{
"id": "jvasp-122129",
"created_at": "2022-09-04T14:38:55.041418Z",
"updated_at": "2022-09-04T14:38:55.041447Z",
"structure_string": "Dy6 Co4 Si6\n1.0\n5.584686 0.010696 0.000000\n-4.095526 3.796774 0.000000\n0.000000 -0.000000 13.607941\nDy Co Si\n6 4 6\ndirect\n0.638524 0.361476 0.250000 Dy\n0.361476 0.638524 0.750000 Dy\n0.919486 0.080516 0.111697 Dy\n0.080514 0.919483 0.888303 Dy\n0.080514 0.919483 0.611697 Dy\n0.919486 0.080516 0.388303 Dy\n0.785879 0.214122 0.581919 Co\n0.214121 0.785878 0.418081 Co\n0.214121 0.785878 0.081919 Co\n0.785879 0.214122 0.918081 Co\n0.332350 0.667649 0.250000 Si\n0.667650 0.332351 0.750000 Si\n0.621680 0.378320 0.040266 Si\n0.378320 0.621680 0.959734 Si\n0.378320 0.621680 0.540266 Si\n0.621680 0.378320 0.459734 Si\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Dy",
"Co",
"Si"
],
"chemical_system": "Co-Dy-Si",
"density": 7.92115545283895,
"density_atomic": 0.05533727354708032,
"volume": 289.1360375098239,
"volume_molar": 10.882611979204997,
"formula_full": "Dy6 Co4 Si6",
"formula_reduced": "Dy3Co2Si3",
"formula_anonymous": "A2B3C3",
"energy_above_hull": null,
"spacegroup": 63
},
{
"id": "jvasp-86270",
"created_at": "2022-09-04T14:35:57.099342Z",
"updated_at": "2022-09-04T14:35:57.099368Z",
"structure_string": "Ce6 Sb6 Au4\n1.0\n4.634376 -0.000000 0.000000\n-2.317188 4.013487 0.000000\n0.000000 -0.000000 23.728182\nCe Sb Au\n6 6 4\ndirect\n0.666668 0.333333 0.925673 Ce\n0.333333 0.666667 0.074327 Ce\n0.333333 0.666667 0.425673 Ce\n0.666668 0.333333 0.574327 Ce\n0.333333 0.666667 0.250000 Ce\n0.666668 0.333333 0.750000 Ce\n0.333333 0.666667 0.651523 Sb\n0.000000 0.000000 0.500000 Sb\n0.666668 0.333333 0.348477 Sb\n0.333333 0.666667 0.848477 Sb\n0.666668 0.333333 0.151523 Sb\n0.000000 0.000000 0.000000 Sb\n0.000000 0.000000 0.812429 Au\n0.000000 0.000000 0.187571 Au\n0.000000 0.000000 0.312429 Au\n0.000000 0.000000 0.687571 Au\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Ce",
"Sb",
"Au"
],
"chemical_system": "Au-Ce-Sb",
"density": 8.876095312078457,
"density_atomic": 0.036252869759759644,
"volume": 441.3443709705943,
"volume_molar": 16.611487035116106,
"formula_full": "Ce6 Sb6 Au4",
"formula_reduced": "Ce3Sb3Au2",
"formula_anonymous": "A2B3C3",
"energy_above_hull": 1.6698349924999998,
"spacegroup": 194
},
{
"id": "jvasp-2571",
"created_at": "2022-09-04T14:36:43.774774Z",
"updated_at": "2022-09-04T14:36:43.774789Z",
"structure_string": "K3 Cu3 P2\n1.0\n5.259316 0.003289 5.202653\n2.173641 4.789124 5.202653\n0.005102 0.003289 7.397836\nK Cu P\n3 3 2\ndirect\n0.908610 0.908609 0.908609 K\n0.500000 0.500000 0.500000 K\n0.091390 0.091390 0.091390 K\n0.500000 0.000000 0.500000 Cu\n0.500000 0.500000 -0.000000 Cu\n-0.000000 0.500000 0.500000 Cu\n0.254716 0.254716 0.254716 P\n0.745284 0.745283 0.745284 P\n",
"nsites": 8,
"nelements": 3,
"elements": [
"K",
"Cu",
"P"
],
"chemical_system": "Cu-K-P",
"density": 3.3003739806780024,
"density_atomic": 0.04298755033146157,
"volume": 186.10039274894407,
"volume_molar": 14.009034507817807,
"formula_full": "K3 Cu3 P2",
"formula_reduced": "K3Cu3P2",
"formula_anonymous": "A2B3C3",
"energy_above_hull": 0.22471454375,
"spacegroup": 166
},
{
"id": "jvasp-108068",
"created_at": "2022-09-04T14:35:56.998945Z",
"updated_at": "2022-09-04T14:35:56.998964Z",
"structure_string": "Tb2 In3 Sn3\n1.0\n4.695315 0.000000 0.000000\n0.000000 4.782306 0.000000\n0.000000 0.000000 9.144800\nTb In Sn\n2 3 3\ndirect\n0.000000 0.000000 0.247409 Tb\n0.000000 0.000000 0.752591 Tb\n0.500001 0.500000 0.253086 In\n0.500001 0.500000 0.746914 In\n-0.000000 0.500000 0.500000 In\n-0.000000 0.500000 -0.000000 Sn\n0.500001 0.000000 0.500000 Sn\n0.500001 0.000000 -0.000000 Sn\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Tb",
"In",
"Sn"
],
"chemical_system": "In-Sn-Tb",
"density": 8.23580355215449,
"density_atomic": 0.03895952742373924,
"volume": 205.34129977986728,
"volume_molar": 15.457427638946474,
"formula_full": "Tb2 In3 Sn3",
"formula_reduced": "Tb2(InSn)3",
"formula_anonymous": "A2B3C3",
"energy_above_hull": 0.32702397625,
"spacegroup": 47
},
{
"id": "jvasp-119366",
"created_at": "2022-09-04T14:38:49.295295Z",
"updated_at": "2022-09-04T14:38:49.295322Z",
"structure_string": "V6 O9 F9\n1.0\n5.035520 -0.003383 -0.022364\n-2.511185 4.428521 -0.089428\n-0.004007 0.039701 13.076930\nV O F\n6 9 9\ndirect\n0.996466 0.972479 0.486417 V\n0.948799 0.977209 0.997986 V\n0.643285 0.324994 0.156709 V\n0.381488 0.677062 0.328924 V\n0.715376 0.349486 0.664249 V\n0.324186 0.637920 0.824739 V\n0.668553 0.923339 0.417972 O\n0.655721 0.746863 0.919164 O\n0.921809 0.264034 0.588007 O\n0.393971 0.417155 0.750953 O\n0.596774 0.590217 0.252318 O\n0.766188 0.084134 0.086129 O\n0.980825 0.589177 0.753550 O\n0.354982 0.264357 0.082041 O\n0.077943 0.746809 0.418346 O\n0.722900 0.665437 0.583820 F\n0.002544 0.405804 0.255239 F\n0.395191 0.997327 0.249593 F\n0.320760 0.070079 0.589758 F\n0.052733 0.337784 0.919473 F\n0.280395 0.338005 0.421285 F\n0.590977 0.007064 0.752514 F\n0.254950 0.941345 0.917961 F\n0.953190 0.671919 0.082854 F\n",
"nsites": 24,
"nelements": 3,
"elements": [
"V",
"O",
"F"
],
"chemical_system": "F-O-V",
"density": 3.535156188360067,
"density_atomic": 0.08232628639837528,
"volume": 291.52292724421545,
"volume_molar": 7.314967094299602,
"formula_full": "V6 O9 F9",
"formula_reduced": "V2(OF)3",
"formula_anonymous": "A2B3C3",
"energy_above_hull": 1.9200212184375,
"spacegroup": 1
},
{
"id": "jvasp-101142",
"created_at": "2022-09-04T14:36:49.268870Z",
"updated_at": "2022-09-04T14:36:49.268890Z",
"structure_string": "Nb3 Al2 Mo3\n1.0\n5.088484 0.004792 -0.015961\n-0.016026 5.088461 -0.015961\n0.004772 0.004792 5.088506\nNb Al Mo\n3 2 3\ndirect\n0.499999 0.247739 0.752261 Nb\n0.247739 0.752260 0.500001 Nb\n0.752259 0.500000 0.247740 Nb\n0.753057 0.753058 0.753059 Al\n0.246941 0.246942 0.246942 Al\n-0.000001 0.250498 0.749502 Mo\n0.250497 0.749502 0.000000 Mo\n0.749501 -0.000000 0.250499 Mo\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Nb",
"Al",
"Mo"
],
"chemical_system": "Al-Mo-Nb",
"density": 7.8203002824645536,
"density_atomic": 0.06071849259815257,
"volume": 131.755576557963,
"volume_molar": 9.918132849337617,
"formula_full": "Nb3 Al2 Mo3",
"formula_reduced": "Nb3Al2Mo3",
"formula_anonymous": "A2B3C3",
"energy_above_hull": 5.481025187499999,
"spacegroup": 155
},
{
"id": "jvasp-86220",
"created_at": "2022-09-04T14:35:54.584646Z",
"updated_at": "2022-09-04T14:35:54.584657Z",
"structure_string": "Ba6 Al6 Ga4\n1.0\n5.970236 -0.000000 0.000000\n-2.985118 5.170376 -0.000000\n-0.000000 -0.000000 14.728682\nBa Al Ga\n6 6 4\ndirect\n0.333333 0.666668 0.877778 Ba\n0.666667 0.333333 0.377778 Ba\n0.666667 0.333333 0.122222 Ba\n0.000000 0.000000 0.000000 Ba\n0.333333 0.666668 0.622222 Ba\n0.000000 0.000000 0.500000 Ba\n0.841613 0.683227 0.750000 Al\n0.683227 0.841613 0.250000 Al\n0.841613 0.158387 0.750000 Al\n0.158387 0.841613 0.250000 Al\n0.316774 0.158387 0.750000 Al\n0.158387 0.316774 0.250000 Al\n0.666667 0.333333 0.888216 Ga\n0.333333 0.666668 0.111784 Ga\n0.333333 0.666668 0.388216 Ga\n0.666667 0.333333 0.611783 Ga\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Ba",
"Al",
"Ga"
],
"chemical_system": "Al-Ba-Ga",
"density": 4.619276403371508,
"density_atomic": 0.035191880248921246,
"volume": 454.65033089530516,
"volume_molar": 17.112301807700653,
"formula_full": "Ba6 Al6 Ga4",
"formula_reduced": "Ba3Al3Ga2",
"formula_anonymous": "A2B3C3",
"energy_above_hull": 0.5021053937500001,
"spacegroup": 194
},
{
"id": "jvasp-85385",
"created_at": "2022-09-04T14:36:02.316827Z",
"updated_at": "2022-09-04T14:36:02.316845Z",
"structure_string": "Ce3 In3 Ru2\n1.0\n4.650901 -0.000000 -1.360731\n-0.177700 4.906420 -0.607370\n-0.041389 0.018605 8.487161\nCe In Ru\n3 3 2\ndirect\n0.828059 0.421968 0.656117 Ce\n0.171941 0.578031 0.343883 Ce\n0.000000 0.000000 0.000000 Ce\n0.369431 0.950860 0.738862 In\n0.500000 0.500000 0.000000 In\n0.630568 0.049139 0.261138 In\n0.789690 0.869988 0.579380 Ru\n0.210310 0.130011 0.420620 Ru\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Ce",
"In",
"Ru"
],
"chemical_system": "Ce-In-Ru",
"density": 8.299983813537354,
"density_atomic": 0.041354017798889135,
"volume": 193.45157800398533,
"volume_molar": 14.562407912301493,
"formula_full": "Ce3 In3 Ru2",
"formula_reduced": "Ce3In3Ru2",
"formula_anonymous": "A2B3C3",
"energy_above_hull": 1.99020592625,
"spacegroup": 12
},
{
"id": "jvasp-112570",
"created_at": "2022-09-04T14:38:42.271592Z",
"updated_at": "2022-09-04T14:38:42.271619Z",
"structure_string": "Tm6 Fe4 Ge6\n1.0\n5.627823 0.003729 0.000000\n-4.128242 3.824921 0.000000\n-0.000000 0.000000 13.613871\nTm Fe Ge\n6 4 6\ndirect\n0.641193 0.358807 0.250000 Tm\n0.358807 0.641193 0.750000 Tm\n0.919434 0.080566 0.111215 Tm\n0.080566 0.919434 0.888785 Tm\n0.080566 0.919434 0.611215 Tm\n0.919434 0.080566 0.388785 Tm\n0.785004 0.214996 0.583828 Fe\n0.214996 0.785003 0.416172 Fe\n0.214996 0.785003 0.083828 Fe\n0.785004 0.214996 0.916172 Fe\n0.333942 0.666058 0.250000 Ge\n0.666058 0.333942 0.750000 Ge\n0.622187 0.377813 0.041618 Ge\n0.377813 0.622187 0.958382 Ge\n0.377813 0.622187 0.541618 Ge\n0.622187 0.377813 0.458382 Ge\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Tm",
"Fe",
"Ge"
],
"chemical_system": "Fe-Ge-Tm",
"density": 9.472065042664232,
"density_atomic": 0.054558821278929706,
"volume": 293.2614676222689,
"volume_molar": 11.037886484409288,
"formula_full": "Tm6 Fe4 Ge6",
"formula_reduced": "Tm3Fe2Ge3",
"formula_anonymous": "A2B3C3",
"energy_above_hull": 1.8560152,
"spacegroup": 63
},
{
"id": "jvasp-22455",
"created_at": "2022-09-04T14:38:32.963635Z",
"updated_at": "2022-09-04T14:38:32.963655Z",
"structure_string": "Sc6 Co4 Si6\n1.0\n3.936285 0.000000 0.000000\n-1.968142 4.955323 0.000000\n0.000000 0.000000 12.866311\nSc Co Si\n6 4 6\ndirect\n0.143039 0.286078 0.750000 Sc\n0.420446 0.840892 0.612905 Sc\n0.420446 0.840892 0.887095 Sc\n0.579553 0.159108 0.112905 Sc\n0.856960 0.713922 0.250000 Sc\n0.579553 0.159108 0.387095 Sc\n0.714971 0.429942 0.584751 Co\n0.285028 0.570058 0.084751 Co\n0.714971 0.429942 0.915249 Co\n0.285028 0.570058 0.415249 Co\n0.162292 0.324582 0.250000 Si\n0.885524 0.771048 0.458965 Si\n0.885524 0.771048 0.041035 Si\n0.114476 0.228951 0.541035 Si\n0.837707 0.675417 0.750000 Si\n0.114476 0.228951 0.958965 Si\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Sc",
"Co",
"Si"
],
"chemical_system": "Co-Sc-Si",
"density": 4.459481486732389,
"density_atomic": 0.06375399946940305,
"volume": 250.96464744425566,
"volume_molar": 9.445902704331763,
"formula_full": "Sc6 Co4 Si6",
"formula_reduced": "Sc3Co2Si3",
"formula_anonymous": "A2B3C3",
"energy_above_hull": 3.36007791875,
"spacegroup": 63
},
{
"id": "jvasp-50020",
"created_at": "2022-09-04T14:37:14.518141Z",
"updated_at": "2022-09-04T14:37:14.518175Z",
"structure_string": "Ti6 N4 O6\n1.0\n3.839403 0.000000 -0.000000\n-1.919702 4.899759 -0.000000\n0.000000 -0.000000 9.893011\nTi N O\n6 4 6\ndirect\n0.199379 0.398757 0.250000 Ti\n0.143403 0.286806 0.946825 Ti\n0.143403 0.286806 0.553175 Ti\n0.800621 0.601243 0.750000 Ti\n0.856597 0.713194 0.053175 Ti\n0.856597 0.713194 0.446825 Ti\n0.307694 0.615388 0.423008 N\n0.307694 0.615388 0.076992 N\n0.692306 0.384612 0.576992 N\n0.692306 0.384612 0.923008 N\n0.248971 0.497941 0.750000 O\n0.044796 0.089590 0.118432 O\n0.044796 0.089590 0.381568 O\n0.955204 0.910410 0.881568 O\n0.751029 0.502059 0.250000 O\n0.955204 0.910410 0.618432 O\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Ti",
"N",
"O"
],
"chemical_system": "N-O-Ti",
"density": 3.918947410172639,
"density_atomic": 0.0859712163810379,
"volume": 186.10880098619862,
"volume_molar": 7.004833726335718,
"formula_full": "Ti6 N4 O6",
"formula_reduced": "Ti3N2O3",
"formula_anonymous": "A2B3C3",
"energy_above_hull": 3.910889,
"spacegroup": 63
}
]
}