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=-elements&page=4010",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-elements&page=4008",
"results": [
{
"id": "jvasp-14492",
"created_at": "2022-09-04T14:38:08.402752Z",
"updated_at": "2022-09-04T14:38:08.402771Z",
"structure_string": "Nb3 O3\n1.0\n4.262864 0.000000 0.000000\n0.000000 4.262864 0.000000\n-0.000000 -0.000000 4.262864\nNb O\n3 3\ndirect\n0.500000 0.000000 0.500000 Nb\n0.500000 0.500000 0.000000 Nb\n0.000000 0.500000 0.500000 Nb\n0.000000 0.500000 0.000000 O\n0.000000 0.000000 0.500000 O\n0.500000 0.000000 0.000000 O\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Nb",
"O"
],
"chemical_system": "Nb-O",
"density": 7.003527687075322,
"density_atomic": 0.07745452915850753,
"volume": 77.46480503059085,
"volume_molar": 7.775065997336238,
"formula_full": "Nb3 O3",
"formula_reduced": "NbO",
"formula_anonymous": "AB",
"energy_above_hull": 1.56969645,
"spacegroup": 221
},
{
"id": "jvasp-9164",
"created_at": "2022-09-04T14:38:07.980535Z",
"updated_at": "2022-09-04T14:38:07.980558Z",
"structure_string": "Nb4 O10\n1.0\n4.622615 0.000000 -1.771761\n-0.521199 5.448243 -1.359834\n0.011119 0.013327 6.945210\nNb O\n4 10\ndirect\n0.380795 0.250348 0.280115 Nb\n0.100680 0.249652 0.719886 Nb\n0.619206 0.749652 0.719886 Nb\n0.899321 0.750348 0.280115 Nb\n0.721644 0.372233 0.588084 O\n0.133561 0.127767 0.411917 O\n0.278357 0.627767 0.411917 O\n0.866440 0.872233 0.588084 O\n0.899602 0.750000 0.000001 O\n0.100399 0.250000 0.000000 O\n0.335369 0.531074 0.781880 O\n0.553490 0.968926 0.218121 O\n0.664632 0.468926 0.218121 O\n0.446511 0.031074 0.781880 O\n",
"nsites": 14,
"nelements": 2,
"elements": [
"Nb",
"O"
],
"chemical_system": "Nb-O",
"density": 5.0409882926230285,
"density_atomic": 0.07994544201358599,
"volume": 175.119427041517,
"volume_molar": 7.532813138961184,
"formula_full": "Nb4 O10",
"formula_reduced": "Nb2O5",
"formula_anonymous": "A2B5",
"energy_above_hull": 3.366798042857143,
"spacegroup": 15
},
{
"id": "jvasp-7655",
"created_at": "2022-09-04T14:36:41.322591Z",
"updated_at": "2022-09-04T14:36:41.322614Z",
"structure_string": "Nb2 O5\n1.0\n3.799774 0.068876 1.071932\n0.264311 3.791197 1.071932\n0.418271 0.397274 5.782303\nNb O\n2 5\ndirect\n0.852336 0.765018 0.291672 Nb\n0.234983 0.147662 0.708327 Nb\n0.274045 0.725955 0.499999 O\n0.634939 0.222100 0.346793 O\n0.246776 0.108983 0.043647 O\n0.891016 0.753224 0.956352 O\n0.777900 0.365061 0.653206 O\n",
"nsites": 7,
"nelements": 2,
"elements": [
"Nb",
"O"
],
"chemical_system": "Nb-O",
"density": 5.51608198583211,
"density_atomic": 0.08747999141078439,
"volume": 80.01829775142218,
"volume_molar": 6.884020749066513,
"formula_full": "Nb2 O5",
"formula_reduced": "Nb2O5",
"formula_anonymous": "A2B5",
"energy_above_hull": 3.4127751857142856,
"spacegroup": 5
},
{
"id": "jvasp-116379",
"created_at": "2022-09-04T14:38:41.459236Z",
"updated_at": "2022-09-04T14:38:41.459261Z",
"structure_string": "Nb1 O2\n1.0\n3.080330 0.000000 0.000000\n0.000000 3.084331 0.000000\n0.000000 0.000000 4.416567\nNb O\n1 2\ndirect\n0.133329 0.000000 0.000000 Nb\n-0.366664 0.000000 0.726065 O\n-0.366664 0.000000 0.273934 O\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Nb",
"O"
],
"chemical_system": "Nb-O",
"density": 4.942953209936714,
"density_atomic": 0.07149541758945374,
"volume": 41.96073120695401,
"volume_molar": 8.423114324026724,
"formula_full": "Nb1 O2",
"formula_reduced": "NbO2",
"formula_anonymous": "AB2",
"energy_above_hull": 2.649462133333333,
"spacegroup": 47
},
{
"id": "jvasp-18420",
"created_at": "2022-09-04T14:36:16.000611Z",
"updated_at": "2022-09-04T14:36:16.000638Z",
"structure_string": "Nb2 O4\n1.0\n1.504266 -2.605463 -0.000000\n1.504266 2.605463 0.000000\n-0.000000 -0.000000 9.609676\nNb O\n2 4\ndirect\n0.666668 0.333335 0.750031 Nb\n0.333335 0.666668 0.249969 Nb\n0.666668 0.333335 0.126636 O\n0.666668 0.333335 0.373305 O\n0.333335 0.666668 0.626696 O\n0.333335 0.666668 0.873364 O\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Nb",
"O"
],
"chemical_system": "Nb-O",
"density": 5.506951505986828,
"density_atomic": 0.07965315082770942,
"volume": 75.32658705464222,
"volume_molar": 7.560455170224154,
"formula_full": "Nb2 O4",
"formula_reduced": "NbO2",
"formula_anonymous": "AB2",
"energy_above_hull": 2.2799721333333336,
"spacegroup": 194
},
{
"id": "jvasp-12003",
"created_at": "2022-09-04T14:37:28.908627Z",
"updated_at": "2022-09-04T14:37:28.908657Z",
"structure_string": "Nb2 O4\n1.0\n3.008490 -0.000027 0.000061\n-1.504269 2.605460 -0.000102\n0.000245 -0.000240 9.611081\nNb O\n2 4\ndirect\n0.666610 0.333297 0.249998 Nb\n0.333393 0.666670 0.750001 Nb\n0.666722 0.333351 0.873322 O\n0.666658 0.333276 0.626681 O\n0.333348 0.666683 0.373318 O\n0.333273 0.666619 0.126679 O\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Nb",
"O"
],
"chemical_system": "Nb-O",
"density": 5.506258215798897,
"density_atomic": 0.07964312300236055,
"volume": 75.33607138713239,
"volume_molar": 7.561407103311995,
"formula_full": "Nb2 O4",
"formula_reduced": "NbO2",
"formula_anonymous": "AB2",
"energy_above_hull": 2.2800188,
"spacegroup": 194
},
{
"id": "jvasp-14944",
"created_at": "2022-09-04T14:36:32.820508Z",
"updated_at": "2022-09-04T14:36:32.820536Z",
"structure_string": "Nb2 O4\n1.0\n4.990947 -0.000000 0.000000\n-0.000000 4.990947 0.000000\n0.000000 0.000000 2.955253\nNb O\n2 4\ndirect\n0.500000 0.500000 0.499999 Nb\n0.000000 0.000000 0.000000 Nb\n0.710477 0.710477 0.000000 O\n0.210476 0.789524 0.499999 O\n0.289524 0.289524 0.000000 O\n0.789524 0.210476 0.499999 O\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Nb",
"O"
],
"chemical_system": "Nb-O",
"density": 5.635065387016954,
"density_atomic": 0.0815062040601052,
"volume": 73.61402814901568,
"volume_molar": 7.388567323732912,
"formula_full": "Nb2 O4",
"formula_reduced": "NbO2",
"formula_anonymous": "AB2",
"energy_above_hull": 2.177205466666667,
"spacegroup": 136
},
{
"id": "jvasp-115267",
"created_at": "2022-09-04T14:38:45.958519Z",
"updated_at": "2022-09-04T14:38:45.958542Z",
"structure_string": "Nb1 O3\n1.0\n3.695428 -1.020156 0.172465\n1.534203 -4.397053 0.411126\n1.296528 -0.946513 -2.944093\nNb O\n1 3\ndirect\n0.888181 0.774174 -0.036049 Nb\n0.240130 0.860847 0.242626 O\n0.515323 0.264888 0.896385 O\n0.868029 0.547981 0.574901 O\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Nb",
"O"
],
"chemical_system": "Nb-O",
"density": 5.215998408589901,
"density_atomic": 0.08917091731530519,
"volume": 44.85767468171424,
"volume_molar": 6.753480777489285,
"formula_full": "Nb1 O3",
"formula_reduced": "NbO3",
"formula_anonymous": "AB3",
"energy_above_hull": 2.684204975,
"spacegroup": 8
},
{
"id": "jvasp-120554",
"created_at": "2022-09-04T14:38:45.491339Z",
"updated_at": "2022-09-04T14:38:45.491365Z",
"structure_string": "Nb4 O9\n1.0\n4.749720 -0.014869 -1.663073\n-0.691441 5.303838 -1.539431\n0.045821 -0.083799 6.965668\nNb O\n4 9\ndirect\n0.368616 0.258336 0.279252 Nb\n0.157240 0.213445 0.736641 Nb\n0.601609 0.723286 0.701990 Nb\n0.889963 0.753201 0.265117 Nb\n0.127088 0.129606 0.412755 O\n0.257443 0.645698 0.406390 O\n0.871719 0.878930 0.595525 O\n0.872077 0.717652 0.974158 O\n0.098703 0.256968 0.002506 O\n0.310445 0.546574 0.772899 O\n0.567517 0.979161 0.241299 O\n0.665292 0.464887 0.230211 O\n0.486280 0.060273 0.791945 O\n",
"nsites": 13,
"nelements": 2,
"elements": [
"Nb",
"O"
],
"chemical_system": "Nb-O",
"density": 4.889767530698366,
"density_atomic": 0.07424250409940406,
"volume": 175.10185247246196,
"volume_molar": 8.11144617635323,
"formula_full": "Nb4 O9",
"formula_reduced": "Nb4O9",
"formula_anonymous": "A4B9",
"energy_above_hull": 3.9352714692307686,
"spacegroup": 1
},
{
"id": "jvasp-7819",
"created_at": "2022-09-04T14:37:05.046443Z",
"updated_at": "2022-09-04T14:37:05.046467Z",
"structure_string": "Nb2 O5\n1.0\n3.710477 0.000000 -1.109952\n-0.014782 4.029077 -0.049413\n0.022399 -0.003530 6.831762\nNb O\n2 5\ndirect\n0.146316 0.064893 0.292632 Nb\n0.853685 0.935108 0.707369 Nb\n0.148623 0.515357 0.297246 O\n0.851378 0.484644 0.702755 O\n0.000000 0.000000 0.000000 O\n0.314737 0.995838 0.629473 O\n0.685264 0.004163 0.370528 O\n",
"nsites": 7,
"nelements": 2,
"elements": [
"Nb",
"O"
],
"chemical_system": "Nb-O",
"density": 4.317469113219688,
"density_atomic": 0.06847109269058656,
"volume": 102.23292377751646,
"volume_molar": 8.795157961350787,
"formula_full": "Nb2 O5",
"formula_reduced": "Nb2O5",
"formula_anonymous": "A2B5",
"energy_above_hull": 3.371195185714286,
"spacegroup": 12
},
{
"id": "jvasp-93368",
"created_at": "2022-09-04T14:35:44.128512Z",
"updated_at": "2022-09-04T14:35:44.128530Z",
"structure_string": "Nb3 O3\n1.0\n4.263131 -0.000000 0.000000\n-0.000000 4.263131 0.000000\n-0.000000 -0.000000 4.263131\nNb O\n3 3\ndirect\n0.000000 0.500000 0.500000 Nb\n0.500000 0.500000 0.000000 Nb\n0.500000 0.000000 0.500000 Nb\n0.000000 0.000000 0.500000 O\n0.000000 0.500000 0.000000 O\n0.500000 0.000000 0.000000 O\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Nb",
"O"
],
"chemical_system": "Nb-O",
"density": 7.00221187615111,
"density_atomic": 0.07743997713270709,
"volume": 77.47936172189127,
"volume_molar": 7.776527038069754,
"formula_full": "Nb3 O3",
"formula_reduced": "NbO",
"formula_anonymous": "AB",
"energy_above_hull": 1.56966145,
"spacegroup": 221
},
{
"id": "jvasp-34900",
"created_at": "2022-09-04T14:38:27.719576Z",
"updated_at": "2022-09-04T14:38:27.719597Z",
"structure_string": "Nb8 O10\n1.0\n6.728818 0.000000 0.000000\n0.000000 6.728818 0.000000\n0.000000 0.000000 4.872195\nNb O\n8 10\ndirect\n0.796040 0.500000 0.796417 Nb\n0.000000 0.703961 0.296418 Nb\n0.296040 0.000000 0.703581 Nb\n0.000000 0.296040 0.296418 Nb\n0.703961 0.000000 0.703581 Nb\n0.500000 0.203960 0.203582 Nb\n0.203960 0.500000 0.796417 Nb\n0.500000 0.796040 0.203582 Nb\n0.286813 0.713188 0.500000 O\n0.713188 0.286813 0.500000 O\n0.213187 0.213187 0.000000 O\n0.286813 0.286813 0.500000 O\n0.786813 0.786813 0.000000 O\n0.500000 0.500000 0.000000 O\n0.786813 0.213187 0.000000 O\n0.713188 0.713188 0.500000 O\n0.213187 0.786813 0.000000 O\n0.000000 0.000000 0.500000 O\n",
"nsites": 18,
"nelements": 2,
"elements": [
"Nb",
"O"
],
"chemical_system": "Nb-O",
"density": 6.799116107893685,
"density_atomic": 0.08159626502576095,
"volume": 220.59833246432515,
"volume_molar": 7.380412275119132,
"formula_full": "Nb8 O10",
"formula_reduced": "Nb4O5",
"formula_anonymous": "A4B5",
"energy_above_hull": 4.218616122222222,
"spacegroup": 137
}
]
}