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=chemical_system&page=4203",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=chemical_system&page=4201",
"results": [
{
"id": "jvasp-100304",
"created_at": "2022-09-04T14:36:40.277671Z",
"updated_at": "2022-09-04T14:36:40.277700Z",
"structure_string": "Sc2 Ta2 N4\n1.0\n3.073646 -0.000000 0.000000\n-1.536823 2.661856 -0.000000\n-0.000000 0.000000 10.637209\nSc Ta N\n2 2 4\ndirect\n0.000000 0.000000 0.000000 Sc\n0.000000 0.000000 0.500000 Sc\n0.333335 0.666668 0.250000 Ta\n0.666668 0.333334 0.750000 Ta\n0.333335 0.666668 0.624296 N\n0.666668 0.333334 0.375704 N\n0.666668 0.333334 0.124296 N\n0.333335 0.666668 0.875704 N\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Sc",
"Ta",
"N"
],
"chemical_system": "N-Sc-Ta",
"density": 9.689583348062829,
"density_atomic": 0.09192293658942424,
"volume": 87.02942156572054,
"volume_molar": 6.551292836626859,
"formula_full": "Sc2 Ta2 N4",
"formula_reduced": "ScTaN2",
"formula_anonymous": "ABC2",
"energy_above_hull": 4.438767737499999,
"spacegroup": 194
},
{
"id": "jvasp-103426",
"created_at": "2022-09-04T14:37:00.848270Z",
"updated_at": "2022-09-04T14:37:00.848298Z",
"structure_string": "Sc2 Ta2 N2\n1.0\n3.081692 -0.000000 0.000000\n-1.540845 2.668823 -0.000000\n0.000000 -0.000000 10.304404\nSc Ta N\n2 2 2\ndirect\n0.000000 0.000000 0.500000 Sc\n0.000000 0.000000 0.000000 Sc\n0.666666 0.333333 0.755644 Ta\n0.333331 0.666666 0.244356 Ta\n0.666666 0.333333 0.370260 N\n0.333331 0.666666 0.629740 N\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Sc",
"Ta",
"N"
],
"chemical_system": "N-Sc-Ta",
"density": 9.401484931077762,
"density_atomic": 0.07079773605007841,
"volume": 84.74847268782622,
"volume_molar": 8.506120528685084,
"formula_full": "Sc2 Ta2 N2",
"formula_reduced": "ScTaN",
"formula_anonymous": "ABC",
"energy_above_hull": 3.896669233333333,
"spacegroup": 164
},
{
"id": "jvasp-106697",
"created_at": "2022-09-04T14:36:51.093165Z",
"updated_at": "2022-09-04T14:36:51.093187Z",
"structure_string": "Y1 Sc1 N2\n1.0\n3.188308 0.001519 4.797723\n1.449913 2.839553 4.797723\n0.002479 0.001519 5.760507\nY Sc N\n1 1 2\ndirect\n0.500000 0.500000 0.500000 Y\n0.000000 0.000000 0.000000 Sc\n0.254822 0.254822 0.254822 N\n0.745178 0.745178 0.745178 N\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Y",
"Sc",
"N"
],
"chemical_system": "N-Sc-Y",
"density": 5.160013950283732,
"density_atomic": 0.07678591319132926,
"volume": 52.092888314463444,
"volume_molar": 7.84276765061645,
"formula_full": "Y1 Sc1 N2",
"formula_reduced": "YScN2",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.4453993,
"spacegroup": 166
},
{
"id": "jvasp-110128",
"created_at": "2022-09-04T14:38:11.533133Z",
"updated_at": "2022-09-04T14:38:11.533160Z",
"structure_string": "Y1 Sc3 N4\n1.0\n4.219148 0.002142 -3.744362\n-0.851251 4.132383 -3.744362\n-0.001745 -0.002142 5.641051\nY Sc N\n1 3 4\ndirect\n0.000000 0.000000 0.000000 Y\n0.250001 0.750000 0.500001 Sc\n0.500000 0.499999 0.000000 Sc\n0.750001 0.250000 0.500001 Sc\n0.000001 0.500000 0.500000 N\n0.257725 0.257724 0.000000 N\n0.500001 -0.000000 0.500001 N\n0.742276 0.742275 0.000000 N\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Y",
"Sc",
"N"
],
"chemical_system": "N-Sc-Y",
"density": 4.726780618703701,
"density_atomic": 0.0813875595934613,
"volume": 98.29512077718965,
"volume_molar": 7.399338166767959,
"formula_full": "Y1 Sc3 N4",
"formula_reduced": "YSc3N4",
"formula_anonymous": "AB3C4",
"energy_above_hull": 4.3065030250000005,
"spacegroup": 139
},
{
"id": "jvasp-55115",
"created_at": "2022-09-04T14:37:54.384668Z",
"updated_at": "2022-09-04T14:37:54.384685Z",
"structure_string": "Se8 N8\n1.0\n6.227629 0.069179 -1.079161\n-1.169605 6.838723 -0.040668\n0.115078 0.038638 6.937077\nSe N\n8 8\ndirect\n0.558206 0.757316 0.383246 Se\n0.427476 0.240918 0.025211 Se\n0.058206 0.383246 0.757316 Se\n0.572524 0.759082 0.974789 Se\n0.441794 0.242684 0.616754 Se\n0.927476 0.025211 0.240918 Se\n0.941793 0.616754 0.242684 Se\n0.072523 0.974789 0.759082 Se\n0.250000 0.412597 0.587403 N\n0.269912 0.007810 0.592794 N\n0.749999 0.992486 0.007514 N\n0.250000 0.007514 0.992486 N\n0.750000 0.587403 0.412598 N\n0.230089 0.407206 0.992190 N\n0.769911 0.592794 0.007810 N\n0.730088 0.992190 0.407206 N\n",
"nsites": 16,
"nelements": 2,
"elements": [
"Se",
"N"
],
"chemical_system": "N-Se",
"density": 4.159474586333616,
"density_atomic": 0.05388798667738058,
"volume": 296.91218741924126,
"volume_molar": 11.175293662488576,
"formula_full": "Se8 N8",
"formula_reduced": "SeN",
"formula_anonymous": "AB",
"energy_above_hull": 2.591273308333333,
"spacegroup": 15
},
{
"id": "jvasp-100443",
"created_at": "2022-09-04T14:36:39.821851Z",
"updated_at": "2022-09-04T14:36:39.821876Z",
"structure_string": "Si4 Se2 N4\n1.0\n6.098924 0.002013 0.000000\n-2.582602 4.981195 0.000000\n-0.000000 -0.000000 4.915848\nSi Se N\n4 2 4\ndirect\n0.624674 0.166040 0.909654 Si\n0.375325 0.541365 0.909654 Si\n0.375325 0.833959 0.409654 Si\n0.624674 0.458634 0.409654 Si\n-0.000000 0.781998 0.263513 Se\n-0.000000 0.218001 0.763513 Se\n0.555365 0.150055 0.255391 N\n0.444634 0.594689 0.255391 N\n0.444634 0.849943 0.755391 N\n0.555365 0.405310 0.755391 N\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Si",
"Se",
"N"
],
"chemical_system": "N-Se-Si",
"density": 3.627369030560424,
"density_atomic": 0.06694844229421487,
"volume": 149.36867322548767,
"volume_molar": 8.9951917529833,
"formula_full": "Si4 Se2 N4",
"formula_reduced": "Si2SeN2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 3.6546894133333336,
"spacegroup": 36
},
{
"id": "jvasp-119677",
"created_at": "2022-09-04T14:38:36.747118Z",
"updated_at": "2022-09-04T14:38:36.747140Z",
"structure_string": "Ta4 Se4 N4\n1.0\n6.612500 -0.021523 2.535770\n1.182773 3.752558 -0.000000\n-0.020846 0.006570 9.269710\nTa Se N\n4 4 4\ndirect\n0.635353 0.682324 0.855372 Ta\n0.364646 0.317678 0.144628 Ta\n0.210021 0.394989 0.884028 Ta\n0.789978 0.605012 0.115973 Ta\n0.807567 0.596217 0.555286 Se\n0.192432 0.403785 0.444715 Se\n0.324824 0.837589 0.703599 Se\n0.675175 0.162412 0.296402 Se\n0.911767 0.544117 0.879064 N\n0.088232 0.455884 0.120936 N\n0.525574 0.237213 0.885999 N\n0.474425 0.762789 0.114002 N\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Ta",
"Se",
"N"
],
"chemical_system": "N-Se-Ta",
"density": 7.894207808589935,
"density_atomic": 0.05206736051996416,
"volume": 230.47068029113643,
"volume_molar": 11.566057314718176,
"formula_full": "Ta4 Se4 N4",
"formula_reduced": "TaSeN",
"formula_anonymous": "ABC",
"energy_above_hull": 3.6701152722222217,
"spacegroup": 12
},
{
"id": "jvasp-106867",
"created_at": "2022-09-04T14:36:57.790442Z",
"updated_at": "2022-09-04T14:36:57.790461Z",
"structure_string": "Ta2 Se2 N2\n1.0\n3.652215 0.000000 0.000000\n0.000000 3.652215 0.000000\n0.000000 0.000000 6.390943\nTa Se N\n2 2 2\ndirect\n0.500001 0.000000 0.172872 Ta\n-0.000000 0.500001 0.827127 Ta\n0.500001 0.000000 0.621746 Se\n-0.000000 0.500001 0.378254 Se\n0.500001 0.500001 -0.000000 N\n0.000000 0.000000 0.000000 N\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ta",
"Se",
"N"
],
"chemical_system": "N-Se-Ta",
"density": 10.671282741642171,
"density_atomic": 0.07038394975046906,
"volume": 85.24670782574282,
"volume_molar": 8.556127897553614,
"formula_full": "Ta2 Se2 N2",
"formula_reduced": "TaSeN",
"formula_anonymous": "ABC",
"energy_above_hull": 3.6466286055555552,
"spacegroup": 129
},
{
"id": "jvasp-4131",
"created_at": "2022-09-04T14:36:51.050076Z",
"updated_at": "2022-09-04T14:36:51.050102Z",
"structure_string": "Tb4 Se3 N2\n1.0\n3.822286 0.000000 0.956313\n1.902523 6.668692 0.512608\n-0.012568 0.008813 8.167030\nTb Se N\n4 3 2\ndirect\n0.440951 0.267609 0.850490 Tb\n0.559049 0.732390 0.149510 Tb\n0.755380 0.128910 0.360332 Tb\n0.244620 0.871090 0.639668 Tb\n0.835744 0.558629 0.769881 Se\n0.000000 0.000000 0.000000 Se\n0.164256 0.441370 0.230119 Se\n0.351703 0.935074 0.361519 N\n0.648297 0.064925 0.638482 N\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Tb",
"Se",
"N"
],
"chemical_system": "N-Se-Tb",
"density": 7.1810166847616195,
"density_atomic": 0.04321653196469581,
"volume": 208.25363792153024,
"volume_molar": 13.93480801495032,
"formula_full": "Tb4 Se3 N2",
"formula_reduced": "Tb4Se3N2",
"formula_anonymous": "A2B3C4",
"energy_above_hull": 2.4402878,
"spacegroup": 12
},
{
"id": "jvasp-2631",
"created_at": "2022-09-04T14:36:58.339475Z",
"updated_at": "2022-09-04T14:36:58.339498Z",
"structure_string": "Th2 Se1 N2\n1.0\n2.024220 -3.506051 0.000000\n2.024220 3.506051 0.000000\n0.000000 0.000000 7.199295\nTh Se N\n2 1 2\ndirect\n0.666667 0.333333 0.704546 Th\n0.333333 0.666667 0.295454 Th\n0.000000 0.000000 0.000000 Se\n0.333333 0.666667 0.627651 N\n0.666667 0.333333 0.372350 N\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Th",
"Se",
"N"
],
"chemical_system": "N-Se-Th",
"density": 9.27955098444548,
"density_atomic": 0.04892987410026992,
"volume": 102.18706039900515,
"volume_molar": 12.307697231468614,
"formula_full": "Th2 Se1 N2",
"formula_reduced": "Th2SeN2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 3.509576213333333,
"spacegroup": 164
},
{
"id": "jvasp-15131",
"created_at": "2022-09-04T14:36:58.236451Z",
"updated_at": "2022-09-04T14:36:58.236470Z",
"structure_string": "U2 Se1 N2\n1.0\n1.922328 -3.329570 -0.000000\n1.922328 3.329570 0.000000\n0.000000 0.000000 6.872325\nU Se N\n2 1 2\ndirect\n0.666668 0.333334 0.295007 U\n0.333334 0.666668 0.704994 U\n0.000000 0.000000 0.000000 Se\n0.333334 0.666668 0.373034 N\n0.666668 0.333334 0.626966 N\n",
"nsites": 5,
"nelements": 3,
"elements": [
"U",
"Se",
"N"
],
"chemical_system": "N-Se-U",
"density": 11.00503888665373,
"density_atomic": 0.056835629889258145,
"volume": 87.97298472353155,
"volume_molar": 10.595713941648732,
"formula_full": "U2 Se1 N2",
"formula_reduced": "U2SeN2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 4.707336373333334,
"spacegroup": 164
},
{
"id": "jvasp-93216",
"created_at": "2022-09-04T14:36:04.099295Z",
"updated_at": "2022-09-04T14:36:04.099325Z",
"structure_string": "Zr2 Se1 N2\n1.0\n3.660070 -0.000001 0.000003\n-1.830036 3.169716 -0.000000\n0.000003 0.000002 6.678103\nZr Se N\n2 1 2\ndirect\n0.666664 0.333332 0.696302 Zr\n0.333334 0.666669 0.303697 Zr\n0.000000 0.000000 0.000000 Se\n0.666666 0.333334 0.368464 N\n0.333332 0.666667 0.631535 N\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Zr",
"Se",
"N"
],
"chemical_system": "N-Se-Zr",
"density": 6.203216648602836,
"density_atomic": 0.06453676859342707,
"volume": 77.4752146563043,
"volume_molar": 9.331332961429592,
"formula_full": "Zr2 Se1 N2",
"formula_reduced": "Zr2SeN2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 3.971439773333332,
"spacegroup": 164
}
]
}