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=-nsites&page=1282",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-nsites&page=1280",
"results": [
{
"id": "jvasp-12406",
"created_at": "2022-09-04T14:36:46.789737Z",
"updated_at": "2022-09-04T14:36:46.789758Z",
"structure_string": "Er4 Si4 Rh4\n1.0\n4.229817 0.000000 0.000000\n-0.000000 6.839622 0.000000\n0.000000 0.000000 7.366762\nEr Si Rh\n4 4 4\ndirect\n0.250000 0.499455 0.690335 Er\n0.750001 0.500545 0.309665 Er\n0.250000 -0.000545 0.809665 Er\n0.750001 0.000545 0.190335 Er\n0.250000 0.294408 0.104345 Si\n0.750001 0.705592 0.895655 Si\n0.250000 0.794408 0.395655 Si\n0.750001 0.205592 0.604345 Si\n0.750001 0.843486 0.570219 Rh\n0.250000 0.156513 0.429781 Rh\n0.750001 0.343486 0.929781 Rh\n0.250000 0.656513 0.070219 Rh\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Er",
"Si",
"Rh"
],
"chemical_system": "Er-Rh-Si",
"density": 9.295210365737873,
"density_atomic": 0.05630551406769056,
"volume": 213.12299867422547,
"volume_molar": 10.69547247674566,
"formula_full": "Er4 Si4 Rh4",
"formula_reduced": "ErSiRh",
"formula_anonymous": "ABC",
"energy_above_hull": 1.8392772,
"spacegroup": 62
},
{
"id": "jvasp-9712",
"created_at": "2022-09-04T14:36:46.802936Z",
"updated_at": "2022-09-04T14:36:46.802960Z",
"structure_string": "Er2 Nb2 O8\n1.0\n4.773666 0.014043 -1.835586\n-1.194657 4.747572 -1.993196\n-0.025477 -0.003261 6.520145\nEr Nb O\n2 2 8\ndirect\n0.378412 0.628412 0.756822 Er\n0.621588 0.371587 0.243176 Er\n0.858163 0.108163 0.716325 Nb\n0.141836 0.891837 0.283673 Nb\n0.991494 0.781047 0.562881 O\n0.571389 0.281836 0.562882 O\n0.008506 0.218953 0.437117 O\n0.428611 0.718163 0.437116 O\n0.214981 0.376584 0.925478 O\n0.710497 0.048894 0.925478 O\n0.785018 0.623415 0.074520 O\n0.289502 0.951106 0.074520 O\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Er",
"Nb",
"O"
],
"chemical_system": "Er-Nb-O",
"density": 7.29294674793746,
"density_atomic": 0.0812908714371539,
"volume": 147.6180509305675,
"volume_molar": 7.4081390118393875,
"formula_full": "Er2 Nb2 O8",
"formula_reduced": "ErNbO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.4916689000000005,
"spacegroup": 15
},
{
"id": "jvasp-9714",
"created_at": "2022-09-04T14:36:51.867655Z",
"updated_at": "2022-09-04T14:36:51.867675Z",
"structure_string": "Y2 Nb2 O8\n1.0\n4.795860 0.009583 -1.840262\n-1.214490 4.791454 -2.010727\n-0.012543 0.000072 6.571966\nY Nb O\n2 2 8\ndirect\n0.378645 0.128644 0.757291 Y\n0.621354 0.871353 0.242709 Y\n0.857062 0.607061 0.714124 Nb\n0.142938 0.392937 0.285876 Nb\n0.427622 0.220002 0.436818 O\n0.009195 0.716814 0.436818 O\n0.572378 0.779996 0.563182 O\n0.990805 0.283184 0.563182 O\n0.788089 0.127277 0.076665 O\n0.288576 0.449387 0.076665 O\n0.211911 0.872721 0.923335 O\n0.711424 0.550611 0.923335 O\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Y",
"Nb",
"O"
],
"chemical_system": "Nb-O-Y",
"density": 5.406848023741027,
"density_atomic": 0.07947802545931203,
"volume": 150.98512992302858,
"volume_molar": 7.577114208861384,
"formula_full": "Y2 Nb2 O8",
"formula_reduced": "YNbO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.778188141666667,
"spacegroup": 15
},
{
"id": "jvasp-59605",
"created_at": "2022-09-04T14:36:41.415071Z",
"updated_at": "2022-09-04T14:36:41.415100Z",
"structure_string": "Er4 Mn4 Si4\n1.0\n4.091643 -0.000000 0.000000\n0.000000 6.895521 0.000000\n0.000000 0.000000 7.418129\nEr Mn Si\n4 4 4\ndirect\n0.250000 0.005082 0.812136 Er\n0.749999 0.994918 0.187865 Er\n0.250000 0.505082 0.687865 Er\n0.749999 0.494918 0.312136 Er\n0.749999 0.857178 0.561445 Mn\n0.250000 0.142822 0.438556 Mn\n0.749999 0.357178 0.938556 Mn\n0.250000 0.642822 0.061444 Mn\n0.250000 0.290148 0.108782 Si\n0.749999 0.709852 0.891218 Si\n0.250000 0.790148 0.391218 Si\n0.749999 0.209852 0.608782 Si\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Er",
"Mn",
"Si"
],
"chemical_system": "Er-Mn-Si",
"density": 7.942924791300499,
"density_atomic": 0.0573352941842214,
"volume": 209.29516750090008,
"volume_molar": 10.503374658984981,
"formula_full": "Er4 Mn4 Si4",
"formula_reduced": "ErMnSi",
"formula_anonymous": "ABC",
"energy_above_hull": 2.4221952804597704,
"spacegroup": 62
},
{
"id": "jvasp-9136",
"created_at": "2022-09-04T14:36:52.435669Z",
"updated_at": "2022-09-04T14:36:52.435684Z",
"structure_string": "Co4 As8\n1.0\n0.000000 5.958667 -0.010160\n5.906588 0.000000 0.000000\n0.000000 -2.627540 -5.403222\nCo As\n4 8\ndirect\n0.271128 0.999311 0.284039 Co\n0.728872 0.499311 0.215961 Co\n0.728872 0.000690 0.715961 Co\n0.271128 0.500690 0.784039 Co\n0.343075 0.635564 0.173174 As\n0.656925 0.135564 0.326826 As\n0.656925 0.364437 0.826826 As\n0.343075 0.864437 0.673174 As\n0.153110 0.366040 0.366535 As\n0.846891 0.866041 0.133464 As\n0.846891 0.633960 0.633464 As\n0.153110 0.133960 0.866535 As\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Co",
"As"
],
"chemical_system": "As-Co",
"density": 7.286046262183287,
"density_atomic": 0.06304965107272226,
"volume": 190.3261920697872,
"volume_molar": 9.551425991325452,
"formula_full": "Co4 As8",
"formula_reduced": "CoAs2",
"formula_anonymous": "AB2",
"energy_above_hull": 2.2422148,
"spacegroup": 14
},
{
"id": "jvasp-50956",
"created_at": "2022-09-04T14:36:47.138392Z",
"updated_at": "2022-09-04T14:36:47.138416Z",
"structure_string": "Ba2 Sr2 I8\n1.0\n-1.812590 0.000000 8.475581\n3.242012 -7.427318 4.254470\n3.242012 7.427318 4.254470\nBa Sr I\n2 2 8\ndirect\n0.750000 0.233183 0.266817 Ba\n0.250000 0.766817 0.733182 Ba\n0.250000 0.381739 0.118261 Sr\n0.750000 0.618260 0.881739 Sr\n0.257212 0.997563 0.119907 I\n0.930508 0.763364 0.126797 I\n0.430508 0.626797 0.263364 I\n0.242789 0.380092 0.502437 I\n0.757212 0.619907 0.497563 I\n0.569492 0.373202 0.736635 I\n0.069493 0.236635 0.873202 I\n0.742789 0.002437 0.880093 I\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Ba",
"Sr",
"I"
],
"chemical_system": "Ba-I-Sr",
"density": 4.654247997897843,
"density_atomic": 0.02295649492640848,
"volume": 522.7278832621591,
"volume_molar": 26.232840768179752,
"formula_full": "Ba2 Sr2 I8",
"formula_reduced": "BaSrI4",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.0012783333333333,
"spacegroup": 15
},
{
"id": "jvasp-12969",
"created_at": "2022-09-04T14:36:40.992473Z",
"updated_at": "2022-09-04T14:36:40.992487Z",
"structure_string": "Pd2 S2 O8\n1.0\n4.694157 0.239797 0.319712\n2.045973 4.231620 0.319712\n-0.131402 -0.087172 8.198739\nPd S O\n2 2 8\ndirect\n-0.000000 0.500000 0.500000 Pd\n0.500000 0.000000 -0.000000 Pd\n0.934792 0.065209 0.250000 S\n0.065208 0.934792 0.750000 S\n0.258995 0.041322 0.217636 O\n0.958678 0.741006 0.282363 O\n0.741005 0.958679 0.782363 O\n0.041322 0.258995 0.717636 O\n0.215114 0.728320 0.604966 O\n0.271681 0.784886 0.895034 O\n0.784886 0.271682 0.395034 O\n0.728320 0.215115 0.104966 O\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Pd",
"S",
"O"
],
"chemical_system": "O-Pd-S",
"density": 4.227240661439945,
"density_atomic": 0.07543474342501803,
"volume": 159.07789242934157,
"volume_molar": 7.983245500113612,
"formula_full": "Pd2 S2 O8",
"formula_reduced": "PdSO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.277491616666667,
"spacegroup": 15
},
{
"id": "jvasp-11983",
"created_at": "2022-09-04T14:36:52.820563Z",
"updated_at": "2022-09-04T14:36:52.820584Z",
"structure_string": "Mg4 Co8\n1.0\n4.797582 0.000000 0.000000\n-2.398791 4.154820 0.000000\n0.000000 0.000000 7.839263\nMg Co\n4 8\ndirect\n0.333335 0.666670 0.063587 Mg\n0.333335 0.666670 0.436412 Mg\n0.666666 0.333331 0.563586 Mg\n0.666666 0.333331 0.936412 Mg\n0.000000 0.000000 0.000000 Co\n0.341711 0.170866 0.250000 Co\n0.829155 0.170866 0.250000 Co\n0.829156 0.658311 0.250000 Co\n0.000000 0.000000 0.500000 Co\n0.170845 0.341690 0.750000 Co\n0.170846 0.829135 0.750000 Co\n0.658290 0.829135 0.750000 Co\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Mg",
"Co"
],
"chemical_system": "Co-Mg",
"density": 6.04326228419259,
"density_atomic": 0.07679472530496537,
"volume": 156.26073213161305,
"volume_molar": 7.84186770131024,
"formula_full": "Mg4 Co8",
"formula_reduced": "MgCo2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.814476747619048,
"spacegroup": 194
},
{
"id": "jvasp-4630",
"created_at": "2022-09-04T14:36:53.303017Z",
"updated_at": "2022-09-04T14:36:53.303026Z",
"structure_string": "Tl2 Pt4 S6\n1.0\n3.596844 -6.229916 0.000000\n3.596844 6.229916 0.000000\n-0.000000 0.000000 5.932069\nTl Pt S\n2 4 6\ndirect\n0.666667 0.333332 0.623707 Tl\n0.333332 0.666667 0.376294 Tl\n0.000000 0.000000 0.000000 Pt\n0.500000 0.500000 -0.000000 Pt\n-0.000000 0.500000 -0.000000 Pt\n0.500000 -0.000000 0.000000 Pt\n0.830417 0.660836 0.199038 S\n0.339163 0.169582 0.199038 S\n0.830418 0.169581 0.199038 S\n0.169581 0.830418 0.800962 S\n0.169582 0.339163 0.800962 S\n0.660836 0.830417 0.800962 S\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Tl",
"Pt",
"S"
],
"chemical_system": "Pt-S-Tl",
"density": 8.628944536746106,
"density_atomic": 0.04513789096964481,
"volume": 265.85203123623984,
"volume_molar": 13.34165294530461,
"formula_full": "Tl2 Pt4 S6",
"formula_reduced": "TlPt2S3",
"formula_anonymous": "AB2C3",
"energy_above_hull": 1.8224909,
"spacegroup": 164
},
{
"id": "jvasp-9421",
"created_at": "2022-09-04T14:36:40.164471Z",
"updated_at": "2022-09-04T14:36:40.164487Z",
"structure_string": "Y4 S4 F4\n1.0\n2.026553 -3.510092 0.000000\n2.026553 3.510092 -0.000000\n-0.000000 0.000000 16.738289\nY S F\n4 4 4\ndirect\n0.666666 0.333332 0.250000 Y\n0.333332 0.666666 0.750000 Y\n0.000000 0.000000 0.500000 Y\n0.000000 0.000000 0.000000 Y\n0.666666 0.333332 0.413999 S\n0.666666 0.333332 0.086001 S\n0.333332 0.666666 0.586001 S\n0.333332 0.666666 0.913999 S\n0.333332 0.666666 0.250000 F\n0.000000 0.000000 0.250000 F\n0.000000 0.000000 0.750000 F\n0.666666 0.333332 0.750000 F\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Y",
"S",
"F"
],
"chemical_system": "F-S-Y",
"density": 3.904129463987679,
"density_atomic": 0.05039224682851018,
"volume": 238.1318705799563,
"volume_molar": 11.95053036728833,
"formula_full": "Y4 S4 F4",
"formula_reduced": "YSF",
"formula_anonymous": "ABC",
"energy_above_hull": 0.3189252441666665,
"spacegroup": 194
},
{
"id": "jvasp-29030",
"created_at": "2022-09-04T14:36:51.791770Z",
"updated_at": "2022-09-04T14:36:51.791789Z",
"structure_string": "Te6 Mo2 W2 Se2\n1.0\n3.503249 -0.000000 0.000000\n-1.751624 3.033902 -0.000020\n0.000001 -0.000232 37.816482\nTe Mo W Se\n6 2 2 2\ndirect\n0.333336 0.666671 0.331604 Te\n0.666630 0.333258 0.043954 Te\n0.666663 0.333324 0.424985 Te\n0.666643 0.333285 0.140986 Te\n0.666662 0.333322 0.522050 Te\n0.333325 0.666649 0.234078 Te\n0.333303 0.666604 0.092428 Mo\n0.333329 0.666656 0.473523 Mo\n0.666664 0.333327 0.282837 W\n0.666707 0.333413 0.654129 W\n0.333375 0.666750 0.696986 Se\n0.333370 0.666740 0.611190 Se\n",
"nsites": 12,
"nelements": 4,
"elements": [
"Te",
"Mo",
"W",
"Se"
],
"chemical_system": "Mo-Se-Te-W",
"density": 6.1271709302855415,
"density_atomic": 0.029855721187402765,
"volume": 401.93301393313,
"volume_molar": 20.17080988330292,
"formula_full": "Te6 Mo2 W2 Se2",
"formula_reduced": "Te3MoWSe",
"formula_anonymous": "ABCD3",
"energy_above_hull": 3.306973761111112,
"spacegroup": 156
},
{
"id": "jvasp-52278",
"created_at": "2022-09-04T14:36:58.276247Z",
"updated_at": "2022-09-04T14:36:58.276272Z",
"structure_string": "Y2 U2 O8\n1.0\n-5.337476 2.677689 2.677689\n0.000000 -0.000000 5.355377\n0.000000 5.355377 -0.000000\nY U O\n2 2 8\ndirect\n0.500000 0.750000 0.250000 Y\n0.000000 0.000000 0.000000 Y\n0.500000 0.250000 0.750000 U\n0.000000 0.500000 0.500000 U\n0.750001 0.375000 0.386244 O\n0.750001 0.875000 0.863756 O\n0.750001 0.875000 0.386244 O\n0.750001 0.375000 0.863756 O\n0.250000 0.136244 0.625000 O\n0.250000 0.613756 0.125000 O\n0.250000 0.613756 0.625000 O\n0.250000 0.136244 0.125000 O\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Y",
"U",
"O"
],
"chemical_system": "O-U-Y",
"density": 8.481344051911616,
"density_atomic": 0.07839082095775018,
"volume": 153.07914693823102,
"volume_molar": 7.6822014190229195,
"formula_full": "Y2 U2 O8",
"formula_reduced": "YUO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.801074241666667,
"spacegroup": 141
}
]
}