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=1072",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=formula_full&page=1070",
"results": [
{
"id": "jvasp-107001",
"created_at": "2022-09-04T14:38:04.388593Z",
"updated_at": "2022-09-04T14:38:04.388607Z",
"structure_string": "Co6 N2\n1.0\n4.524440 -0.000000 0.000000\n-2.262220 3.918280 0.000000\n-0.000000 -0.000000 4.328377\nCo N\n6 2\ndirect\n0.324116 0.000000 -0.000000 Co\n-0.000000 0.324116 -0.000000 Co\n0.675884 0.000000 0.500000 Co\n0.675884 0.675884 -0.000000 Co\n-0.000000 0.675884 0.500000 Co\n0.324116 0.324116 0.500000 Co\n0.333333 0.666667 0.250000 N\n0.666667 0.333333 0.750000 N\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Co",
"N"
],
"chemical_system": "Co-N",
"density": 8.258218846823077,
"density_atomic": 0.10425685158041796,
"volume": 76.73356598371133,
"volume_molar": 5.7762541921332184,
"formula_full": "Co6 N2",
"formula_reduced": "Co3N",
"formula_anonymous": "AB3",
"energy_above_hull": 3.7465914875,
"spacegroup": 182
},
{
"id": "jvasp-108871",
"created_at": "2022-09-04T14:37:57.384416Z",
"updated_at": "2022-09-04T14:37:57.384442Z",
"structure_string": "Co6 Ni2\n1.0\n4.967162 -0.000000 0.000000\n-2.483580 4.301689 0.000000\n-0.000000 -0.000000 4.011864\nCo Ni\n6 2\ndirect\n0.165511 0.331022 0.250000 Co\n0.834489 0.165511 0.749999 Co\n0.331022 0.165511 0.749999 Co\n0.834489 0.668978 0.749999 Co\n0.165511 0.834489 0.250000 Co\n0.668978 0.834489 0.250000 Co\n0.666666 0.333333 0.250000 Ni\n0.333333 0.666667 0.749999 Ni\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Co",
"Ni"
],
"chemical_system": "Co-Ni",
"density": 9.123543188115818,
"density_atomic": 0.09332466753140836,
"volume": 85.72224484279684,
"volume_molar": 6.452892808831334,
"formula_full": "Co6 Ni2",
"formula_reduced": "Co3Ni",
"formula_anonymous": "AB3",
"energy_above_hull": 2.710441275,
"spacegroup": 194
},
{
"id": "jvasp-42436",
"created_at": "2022-09-04T14:37:29.526280Z",
"updated_at": "2022-09-04T14:37:29.526306Z",
"structure_string": "Co6 O1 F11\n1.0\n4.698360 0.038889 0.000000\n0.038889 4.698360 -0.000000\n-0.000000 -0.000000 9.317612\nCo O F\n6 1 11\ndirect\n0.006645 0.993355 0.016076 Co\n0.006645 0.993355 0.317257 Co\n0.004168 0.995831 0.666667 Co\n0.475437 0.524563 0.166667 Co\n0.504435 0.495565 0.835467 Co\n0.504435 0.495565 0.497867 Co\n0.200432 0.799568 0.166667 O\n0.778850 0.221150 0.166667 F\n0.695799 0.702411 0.332919 F\n0.695799 0.702411 0.000414 F\n0.704912 0.693036 0.666667 F\n0.201328 0.798672 0.497079 F\n0.297589 0.304201 0.000414 F\n0.297589 0.304201 0.332919 F\n0.808822 0.191178 0.838666 F\n0.201328 0.798672 0.836254 F\n0.306964 0.295088 0.666667 F\n0.808822 0.191178 0.494667 F\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Co",
"O",
"F"
],
"chemical_system": "Co-F-O",
"density": 4.671386716923715,
"density_atomic": 0.08751954626763318,
"volume": 205.66834230328763,
"volume_molar": 6.880909484590338,
"formula_full": "Co6 O1 F11",
"formula_reduced": "Co6OF11",
"formula_anonymous": "AB6C11",
"energy_above_hull": 1.3347967781944443,
"spacegroup": 38
},
{
"id": "jvasp-44255",
"created_at": "2022-09-04T14:35:44.962127Z",
"updated_at": "2022-09-04T14:35:44.962151Z",
"structure_string": "Co6 O2 F10\n1.0\n4.652594 0.021345 -0.018583\n0.195737 5.554053 0.041801\n0.192451 0.445927 7.741354\nCo O F\n6 2 10\ndirect\n0.467630 0.338258 0.194843 Co\n0.499999 -0.000000 0.500000 Co\n0.532369 0.661742 0.805157 Co\n0.996545 0.172360 0.836811 Co\n0.000000 0.500000 0.500000 Co\n0.003454 0.827639 0.163189 Co\n0.714030 0.700196 0.588668 O\n0.285969 0.299803 0.411332 O\n0.203834 0.792893 0.394732 F\n0.309254 0.635887 0.055796 F\n0.298566 0.970091 0.735253 F\n0.701434 0.029909 0.264747 F\n0.796166 0.207107 0.605268 F\n0.805012 0.529074 0.265259 F\n0.802827 0.866649 0.931253 F\n0.197172 0.133350 0.068747 F\n0.690746 0.364112 0.944204 F\n0.194987 0.470925 0.734741 F\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Co",
"O",
"F"
],
"chemical_system": "Co-F-O",
"density": 4.780273878565684,
"density_atomic": 0.09002621301636819,
"volume": 199.94176581355603,
"volume_molar": 6.6893192085121695,
"formula_full": "Co6 O2 F10",
"formula_reduced": "Co3OF5",
"formula_anonymous": "AB3C5",
"energy_above_hull": 1.3310430680555556,
"spacegroup": 2
},
{
"id": "jvasp-42912",
"created_at": "2022-09-04T14:38:09.999363Z",
"updated_at": "2022-09-04T14:38:09.999374Z",
"structure_string": "Co6 O2 F10\n1.0\n4.661534 -0.001853 0.006528\n-0.038390 5.624900 -0.100772\n-0.034256 -0.337354 7.660326\nCo O F\n6 2 10\ndirect\n0.490264 0.519290 0.003654 Co\n0.472576 0.828332 0.324403 Co\n0.502636 0.160551 0.674924 Co\n0.014869 0.663896 0.640215 Co\n0.015502 0.356543 0.342056 Co\n0.016020 0.980730 0.013145 Co\n0.209785 0.644787 0.423688 O\n0.300866 0.797532 0.106829 O\n0.785585 0.033445 0.240785 F\n0.705088 0.198348 0.909167 F\n0.711872 0.529883 0.228800 F\n0.685104 0.862854 0.554108 F\n0.196123 0.962468 0.766655 F\n0.298308 0.463573 0.768065 F\n0.203153 0.295833 0.104666 F\n0.803716 0.700193 0.885191 F\n0.294167 0.140384 0.442606 F\n0.794349 0.361372 0.571051 F\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Co",
"O",
"F"
],
"chemical_system": "Co-F-O",
"density": 4.762187160564379,
"density_atomic": 0.08968558844779409,
"volume": 200.70114175007933,
"volume_molar": 6.7147251461760575,
"formula_full": "Co6 O2 F10",
"formula_reduced": "Co3OF5",
"formula_anonymous": "AB3C5",
"energy_above_hull": 1.3294997347222224,
"spacegroup": 1
},
{
"id": "jvasp-42913",
"created_at": "2022-09-04T14:38:07.184957Z",
"updated_at": "2022-09-04T14:38:07.184984Z",
"structure_string": "Co6 O2 F10\n1.0\n5.536239 -0.002975 -0.012860\n1.868053 5.260226 -0.013015\n2.305696 1.585843 6.802287\nCo O F\n6 2 10\ndirect\n0.499999 0.500001 0.000000 Co\n0.500000 0.500000 0.500001 Co\n0.873921 0.800576 0.162521 Co\n0.826854 0.816765 0.676580 Co\n0.173145 0.183236 0.323421 Co\n0.126079 0.199425 0.837480 Co\n0.164513 0.518981 0.159251 O\n0.835486 0.481020 0.840750 O\n0.072634 0.065397 0.134467 F\n0.391081 0.408865 0.800859 F\n0.743114 0.723887 0.464606 F\n0.927366 0.934604 0.865534 F\n0.199519 0.810491 0.496732 F\n0.608919 0.591136 0.199142 F\n0.559999 0.113846 0.166777 F\n0.800481 0.189509 0.503269 F\n0.256885 0.276114 0.535395 F\n0.440001 0.886155 0.833224 F\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Co",
"O",
"F"
],
"chemical_system": "Co-F-O",
"density": 4.818263088784071,
"density_atomic": 0.09074165836914999,
"volume": 198.36534094157102,
"volume_molar": 6.636577805864065,
"formula_full": "Co6 O2 F10",
"formula_reduced": "Co3OF5",
"formula_anonymous": "AB3C5",
"energy_above_hull": 1.3292975125000002,
"spacegroup": 2
},
{
"id": "jvasp-42291",
"created_at": "2022-09-04T14:36:13.373294Z",
"updated_at": "2022-09-04T14:36:13.373324Z",
"structure_string": "Co6 O2 F10\n1.0\n0.000000 5.620293 0.107368\n4.678364 0.000000 0.000000\n0.000000 -0.534012 -7.690676\nCo O F\n6 2 10\ndirect\n0.251746 0.510433 0.023470 Co\n0.561792 0.513803 0.321945 Co\n0.912629 0.480745 0.667766 Co\n0.438208 0.013803 0.678055 Co\n0.087371 0.980744 0.332234 Co\n0.748254 0.010433 0.976530 Co\n0.722450 0.211711 0.760800 O\n0.277550 0.711711 0.239200 O\n0.781809 0.796769 0.218086 F\n0.959888 0.703530 0.897625 F\n0.625128 0.709983 0.558363 F\n0.876441 0.296984 0.423540 F\n0.374872 0.209984 0.441637 F\n0.218191 0.296769 0.781914 F\n0.040111 0.203530 0.102376 F\n0.457236 0.776040 0.898747 F\n0.542764 0.276040 0.101253 F\n0.123559 0.796984 0.576460 F\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Co",
"O",
"F"
],
"chemical_system": "Co-F-O",
"density": 4.732768797238413,
"density_atomic": 0.08913155662646863,
"volume": 201.9486776769104,
"volume_molar": 6.7564631292568,
"formula_full": "Co6 O2 F10",
"formula_reduced": "Co3OF5",
"formula_anonymous": "AB3C5",
"energy_above_hull": 1.330906401388889,
"spacegroup": 4
},
{
"id": "jvasp-43822",
"created_at": "2022-09-04T14:36:10.027926Z",
"updated_at": "2022-09-04T14:36:10.027959Z",
"structure_string": "Co6 O2 F10\n1.0\n4.629396 -0.085082 0.019106\n-0.085082 4.629396 0.019106\n0.039758 0.039758 9.281634\nCo O F\n6 2 10\ndirect\n0.962217 0.962217 0.004429 Co\n0.037785 0.037785 0.328904 Co\n0.000000 0.000000 0.666667 Co\n0.500001 0.500001 0.166667 Co\n0.502770 0.502770 0.845022 Co\n0.497232 0.497232 0.488312 Co\n0.323506 0.323506 0.325459 O\n0.676496 0.676496 0.007875 O\n0.794907 0.205095 0.166667 F\n0.725597 0.725597 0.331510 F\n0.694257 0.694257 0.664303 F\n0.305744 0.305744 0.669030 F\n0.205095 0.794907 0.166667 F\n0.212317 0.815004 0.499206 F\n0.184998 0.787685 0.834128 F\n0.787685 0.184998 0.834128 F\n0.274405 0.274405 0.001824 F\n0.815004 0.212317 0.499206 F\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Co",
"O",
"F"
],
"chemical_system": "Co-F-O",
"density": 4.806683883280359,
"density_atomic": 0.09052358885101806,
"volume": 198.84319908730137,
"volume_molar": 6.652565189291291,
"formula_full": "Co6 O2 F10",
"formula_reduced": "Co3OF5",
"formula_anonymous": "AB3C5",
"energy_above_hull": 1.329425290277778,
"spacegroup": 12
},
{
"id": "jvasp-48095",
"created_at": "2022-09-04T14:35:56.367324Z",
"updated_at": "2022-09-04T14:35:56.367356Z",
"structure_string": "Co6 O2 F10\n1.0\n4.699408 0.000000 0.000000\n0.000000 4.704377 0.000000\n0.000000 0.000000 9.102250\nCo O F\n6 2 10\ndirect\n0.779622 0.021213 0.000000 Co\n0.751918 0.989629 0.347383 Co\n0.751918 0.989629 0.652617 Co\n0.248082 0.489629 0.152617 Co\n0.248082 0.489629 0.847383 Co\n0.220379 0.521213 0.500000 Co\n0.946109 0.794855 0.500000 O\n0.053892 0.294854 0.000000 O\n0.559577 0.193345 0.171795 F\n0.440424 0.693345 0.328205 F\n0.477194 0.714423 0.000000 F\n0.440424 0.693345 0.671795 F\n0.955525 0.801782 0.169346 F\n0.044476 0.301781 0.330654 F\n0.955525 0.801782 0.830654 F\n0.559577 0.193345 0.828205 F\n0.044476 0.301781 0.669346 F\n0.522806 0.214423 0.500000 F\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Co",
"O",
"F"
],
"chemical_system": "Co-F-O",
"density": 4.7496572799953976,
"density_atomic": 0.08944961500237485,
"volume": 201.23060339077043,
"volume_molar": 6.732438993549739,
"formula_full": "Co6 O2 F10",
"formula_reduced": "Co3OF5",
"formula_anonymous": "AB3C5",
"energy_above_hull": 1.330446401388889,
"spacegroup": 31
},
{
"id": "jvasp-44035",
"created_at": "2022-09-04T14:35:54.193487Z",
"updated_at": "2022-09-04T14:35:54.193512Z",
"structure_string": "Co6 O3 F9\n1.0\n4.613252 -0.123533 0.000000\n-0.123533 4.613252 0.000000\n0.000000 0.000000 8.958674\nCo O F\n6 3 9\ndirect\n0.953442 0.953442 0.000000 Co\n0.034139 0.034139 0.335610 Co\n0.034139 0.034139 0.664390 Co\n0.492925 0.492925 0.168603 Co\n0.492925 0.492925 0.831397 Co\n0.499123 0.499123 0.500000 Co\n0.320575 0.320575 0.662827 O\n0.665273 0.665273 0.000000 O\n0.320575 0.320575 0.337172 O\n0.787865 0.196285 0.831213 F\n0.196285 0.787865 0.168787 F\n0.196285 0.787865 0.831213 F\n0.221272 0.796967 0.500000 F\n0.269104 0.269104 0.000000 F\n0.715620 0.715620 0.660735 F\n0.715620 0.715620 0.339265 F\n0.787865 0.196285 0.168787 F\n0.796967 0.221272 0.500000 F\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Co",
"O",
"F"
],
"chemical_system": "Co-F-O",
"density": 4.99046460569064,
"density_atomic": 0.09447696612708939,
"volume": 190.52262935482702,
"volume_molar": 6.374189399667091,
"formula_full": "Co6 O3 F9",
"formula_reduced": "Co2OF3",
"formula_anonymous": "AB2C3",
"energy_above_hull": 1.3065693579166666,
"spacegroup": 38
},
{
"id": "jvasp-48498",
"created_at": "2022-09-04T14:36:11.692722Z",
"updated_at": "2022-09-04T14:36:11.692739Z",
"structure_string": "Co6 O4 F8\n1.0\n4.529232 0.016836 0.025760\n0.016836 4.529232 0.025760\n0.055201 0.055201 9.029097\nCo O F\n6 4 8\ndirect\n0.973158 0.945200 0.990173 Co\n0.054800 0.026843 0.343162 Co\n0.029737 0.970263 0.666667 Co\n0.508761 0.491240 0.166667 Co\n0.478891 0.516117 0.840502 Co\n0.483882 0.521109 0.492832 Co\n0.674922 0.672749 0.000351 O\n0.327251 0.325078 0.332982 O\n0.185986 0.788062 0.831718 O\n0.211938 0.814014 0.501617 O\n0.780585 0.202140 0.825784 F\n0.207910 0.792090 0.166667 F\n0.278757 0.279644 0.992410 F\n0.295905 0.323298 0.662386 F\n0.676702 0.704095 0.670947 F\n0.720356 0.721243 0.340925 F\n0.812597 0.187403 0.166667 F\n0.797860 0.219415 0.507549 F\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Co",
"O",
"F"
],
"chemical_system": "Co-F-O",
"density": 5.106807820418196,
"density_atomic": 0.09718855936727297,
"volume": 185.20698441447703,
"volume_molar": 6.196347388217261,
"formula_full": "Co6 O4 F8",
"formula_reduced": "Co3(OF2)2",
"formula_anonymous": "A2B3C4",
"energy_above_hull": 1.6765412033333331,
"spacegroup": 5
},
{
"id": "jvasp-119727",
"created_at": "2022-09-04T14:38:52.303699Z",
"updated_at": "2022-09-04T14:38:52.303738Z",
"structure_string": "Co6 O4 F8\n1.0\n4.493067 0.020986 0.138655\n0.184432 5.439849 0.336472\n0.020219 0.069334 7.565422\nCo O F\n6 4 8\ndirect\n0.527831 0.511595 0.007573 Co\n0.463179 0.185314 0.348205 Co\n0.499364 0.832626 0.661588 Co\n-0.000627 0.341094 0.672882 Co\n0.006109 0.652417 0.311915 Co\n0.981157 0.982682 0.003923 Co\n0.302415 0.458023 0.228126 O\n0.290501 0.135393 0.571841 O\n0.809744 0.700396 0.100787 O\n0.703724 0.544572 0.768333 O\n0.202728 0.292122 0.909759 F\n0.805006 0.380825 0.426123 F\n0.786939 0.043848 0.769604 F\n0.701601 0.195233 0.115358 F\n0.712752 0.873229 0.425425 F\n0.291914 0.796757 0.894485 F\n0.216873 0.940680 0.235518 F\n0.198796 0.633198 0.548553 F\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Co",
"O",
"F"
],
"chemical_system": "Co-F-O",
"density": 5.119062025342952,
"density_atomic": 0.09742177130018859,
"volume": 184.7636289073011,
"volume_molar": 6.181514336712068,
"formula_full": "Co6 O4 F8",
"formula_reduced": "Co3(OF2)2",
"formula_anonymous": "A2B3C4",
"energy_above_hull": 1.678636758888889,
"spacegroup": 1
}
]
}