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=-density_atomic&page=450",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-density_atomic&page=448",
"results": [
{
"id": "jvasp-113511",
"created_at": "2022-09-04T14:38:47.999603Z",
"updated_at": "2022-09-04T14:38:47.999620Z",
"structure_string": "Be1 B2\n1.0\n3.096552 0.000000 -0.000000\n-1.548276 2.681693 0.000000\n-0.000000 -0.000000 3.775572\nBe B\n1 2\ndirect\n0.000000 0.000000 0.000000 Be\n0.333332 0.666667 0.000000 B\n0.666666 0.333334 0.000000 B\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Be",
"B"
],
"chemical_system": "B-Be",
"density": 1.6225018220781424,
"density_atomic": 0.09568658656484781,
"volume": 31.35235676911589,
"volume_molar": 6.29361018737849,
"formula_full": "Be1 B2",
"formula_reduced": "BeB2",
"formula_anonymous": "AB2",
"energy_above_hull": 3.2642204222222224,
"spacegroup": 191
},
{
"id": "jvasp-15951",
"created_at": "2022-09-04T14:37:06.611982Z",
"updated_at": "2022-09-04T14:37:06.612014Z",
"structure_string": "Zn1 Co3 C1\n1.0\n3.738611 -0.000000 -0.000000\n0.000000 3.738611 0.000000\n-0.000000 0.000000 3.738611\nZn Co C\n1 3 1\ndirect\n0.000000 0.000000 0.000000 Zn\n0.000000 0.500000 0.500000 Co\n0.500000 0.500000 0.000000 Co\n0.500000 0.000000 0.500000 Co\n0.500000 0.500000 0.500000 C\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Zn",
"Co",
"C"
],
"chemical_system": "C-Co-Zn",
"density": 8.078426017130466,
"density_atomic": 0.09568396554025799,
"volume": 52.2553593151018,
"volume_molar": 6.293782585198404,
"formula_full": "Zn1 Co3 C1",
"formula_reduced": "ZnCo3C",
"formula_anonymous": "ABC3",
"energy_above_hull": 3.04225462,
"spacegroup": 221
},
{
"id": "jvasp-26005",
"created_at": "2022-09-04T14:38:35.427338Z",
"updated_at": "2022-09-04T14:38:35.427360Z",
"structure_string": "Ti1 Mn1 H12 O6 F6\n1.0\n6.479960 0.002749 -0.679921\n-0.755280 6.435795 -0.679921\n0.002444 0.002749 6.515533\nTi Mn H O F\n1 1 12 6 6\ndirect\n0.500000 0.500000 0.500000 Ti\n0.000000 0.000000 0.000000 Mn\n0.806825 0.588755 0.949130 H\n0.411245 0.050870 0.193175 H\n0.050869 0.193174 0.411245 H\n0.193174 0.411245 0.050870 H\n0.675866 0.190629 0.819328 H\n0.190628 0.819328 0.675866 H\n0.819328 0.675866 0.190629 H\n0.324133 0.809371 0.180672 H\n0.809371 0.180672 0.324134 H\n0.180671 0.324134 0.809371 H\n0.588754 0.949130 0.806825 H\n0.949130 0.806825 0.588755 H\n0.694982 0.059391 0.878451 O\n0.878451 0.694982 0.059390 O\n0.305018 0.940609 0.121549 O\n0.940609 0.121549 0.305018 O\n0.121548 0.305018 0.940609 O\n0.059390 0.878451 0.694982 O\n0.656424 0.431075 0.741137 F\n0.431075 0.741137 0.656424 F\n0.741137 0.656424 0.431075 F\n0.343575 0.568924 0.258863 F\n0.568924 0.258863 0.343575 F\n0.258862 0.343575 0.568924 F\n",
"nsites": 26,
"nelements": 5,
"elements": [
"Ti",
"Mn",
"H",
"O",
"F"
],
"chemical_system": "F-H-Mn-O-Ti",
"density": 1.9851660085077159,
"density_atomic": 0.09567281536732383,
"volume": 271.75953691940856,
"volume_molar": 6.2945160930811355,
"formula_full": "Ti1 Mn1 H12 O6 F6",
"formula_reduced": "TiMnH12(OF)6",
"formula_anonymous": "ABC6D6E12",
"energy_above_hull": 2.520441471912025,
"spacegroup": 148
},
{
"id": "jvasp-102832",
"created_at": "2022-09-04T14:36:51.797944Z",
"updated_at": "2022-09-04T14:36:51.797966Z",
"structure_string": "Ni1 P2 O7\n1.0\n4.952950 -0.006706 -0.717181\n1.062716 4.837601 0.717180\n-0.019975 0.024874 4.368609\nNi P O\n1 2 7\ndirect\n0.110505 0.110505 0.000000 Ni\n0.259622 0.671398 0.592378 P\n0.671400 0.259619 0.407623 P\n0.809913 0.058148 0.723082 O\n0.131233 0.443084 0.731292 O\n0.864289 0.345254 0.184269 O\n0.345257 0.864287 0.815732 O\n0.550991 0.550988 0.500000 O\n0.058150 0.809912 0.276918 O\n0.443085 0.131231 0.268709 O\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Ni",
"P",
"O"
],
"chemical_system": "Ni-O-P",
"density": 3.695675584076107,
"density_atomic": 0.09566795042339354,
"volume": 104.52821405437693,
"volume_molar": 6.294836184268682,
"formula_full": "Ni1 P2 O7",
"formula_reduced": "NiP2O7",
"formula_anonymous": "AB2C7",
"energy_above_hull": 2.69251079,
"spacegroup": 5
},
{
"id": "jvasp-63765",
"created_at": "2022-09-04T14:36:19.674541Z",
"updated_at": "2022-09-04T14:36:19.674569Z",
"structure_string": "Ni1 B2 W2\n1.0\n-1.605109 2.288474 3.557281\n1.605109 -2.288474 3.557281\n1.605109 2.288474 -3.557281\nNi B W\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Ni\n0.701220 0.500000 0.201220 B\n0.298779 0.500000 0.798780 B\n0.700640 0.200641 0.499999 W\n0.299359 0.799359 0.500000 W\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Ni",
"B",
"W"
],
"chemical_system": "B-Ni-W",
"density": 14.232918927923231,
"density_atomic": 0.0956624122024941,
"volume": 52.267132773280004,
"volume_molar": 6.295200613646027,
"formula_full": "Ni1 B2 W2",
"formula_reduced": "Ni(BW)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 5.4117295133333325,
"spacegroup": 71
},
{
"id": "jvasp-105115",
"created_at": "2022-09-04T14:36:47.366854Z",
"updated_at": "2022-09-04T14:36:47.366877Z",
"structure_string": "Al1 Ag1 O3\n1.0\n3.738976 -0.000000 0.000000\n0.000000 3.738976 0.000000\n-0.000000 -0.000000 3.738976\nAl Ag O\n1 1 3\ndirect\n0.000000 0.000000 0.000000 Al\n0.500001 0.500001 0.500001 Ag\n0.000000 0.000000 0.500001 O\n-0.000000 0.500001 -0.000000 O\n0.500001 0.000000 -0.000000 O\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Al",
"Ag",
"O"
],
"chemical_system": "Ag-Al-O",
"density": 5.80872924260587,
"density_atomic": 0.0956559461802689,
"volume": 52.270665856748984,
"volume_molar": 6.2956261481653675,
"formula_full": "Al1 Ag1 O3",
"formula_reduced": "AlAgO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.554300112,
"spacegroup": 221
},
{
"id": "jvasp-104638",
"created_at": "2022-09-04T14:36:51.750472Z",
"updated_at": "2022-09-04T14:36:51.750490Z",
"structure_string": "Ce1 Mg1 Ni4 H4\n1.0\n4.579371 0.000000 2.643901\n1.526457 4.317473 2.643901\n0.000000 0.000000 5.287802\nCe Mg Ni H\n1 1 4 4\ndirect\n0.000000 0.000000 0.000000 Ce\n0.750000 0.750000 0.749999 Mg\n0.382814 0.382813 0.382813 Ni\n0.382814 0.382813 0.851560 Ni\n0.382814 0.851560 0.382813 Ni\n0.851561 0.382813 0.382813 Ni\n0.163972 0.163972 0.163972 H\n0.163972 0.163972 0.508084 H\n0.163972 0.508084 0.163971 H\n0.508084 0.163972 0.163972 H\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Ce",
"Mg",
"Ni",
"H"
],
"chemical_system": "Ce-H-Mg-Ni",
"density": 6.404531532327792,
"density_atomic": 0.09565096488946077,
"volume": 104.5467759949575,
"volume_molar": 6.295954010458231,
"formula_full": "Ce1 Mg1 Ni4 H4",
"formula_reduced": "CeMg(NiH)4",
"formula_anonymous": "ABC4D4",
"energy_above_hull": 1.874489415,
"spacegroup": 216
},
{
"id": "jvasp-110618",
"created_at": "2022-09-04T14:38:39.517269Z",
"updated_at": "2022-09-04T14:38:39.517289Z",
"structure_string": "Co2 O4\n1.0\n2.824808 -0.000404 -0.000360\n1.411254 4.539070 -0.817419\n0.000415 -0.000793 4.892629\nCo O\n2 4\ndirect\n0.499999 0.000001 0.500000 Co\n0.000000 0.000000 0.000000 Co\n0.601901 0.795933 0.799208 O\n0.101901 0.795933 0.299208 O\n0.898094 0.204070 0.700793 O\n0.398096 0.204068 0.200792 O\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Co",
"O"
],
"chemical_system": "Co-O",
"density": 4.813833545209555,
"density_atomic": 0.09564152820296071,
"volume": 62.73425480265655,
"volume_molar": 6.296575214921729,
"formula_full": "Co2 O4",
"formula_reduced": "CoO2",
"formula_anonymous": "AB2",
"energy_above_hull": 2.072312633333333,
"spacegroup": 166
},
{
"id": "jvasp-104122",
"created_at": "2022-09-04T14:36:55.826551Z",
"updated_at": "2022-09-04T14:36:55.826578Z",
"structure_string": "H16 C26 S2 O2\n1.0\n4.966982 0.078744 0.927856\n1.320505 9.426981 4.083804\n0.299246 0.015924 10.355113\nH C S O\n16 26 2 2\ndirect\n0.384817 0.978753 0.086497 H\n0.352157 0.839504 0.947183 H\n0.557109 0.496771 0.795379 H\n0.057099 -0.003228 0.295379 H\n0.103886 0.354102 0.216726 H\n0.603892 0.854103 0.716726 H\n0.963978 0.695920 0.362179 H\n0.463983 0.195916 0.862191 H\n0.852175 0.339504 0.447192 H\n0.273021 0.063744 0.730016 H\n0.133120 0.209202 0.071820 H\n0.633128 0.709205 0.571812 H\n0.679898 0.630616 0.929160 H\n0.179907 0.130616 0.429164 H\n0.884839 0.478755 0.586501 H\n0.773008 0.563742 0.230011 H\n0.047629 0.713801 0.091404 C\n0.118519 0.849527 0.576420 C\n0.618515 0.349527 0.076423 C\n0.437114 0.920692 0.193480 C\n0.937127 0.420692 0.693485 C\n0.755321 0.430982 0.811519 C\n0.481684 0.614462 0.994952 C\n0.255314 0.930983 0.311516 C\n0.799886 0.232503 0.505252 C\n0.299869 0.732502 0.005245 C\n0.547646 0.213801 0.591412 C\n0.981695 0.114462 0.494956 C\n0.820103 0.352580 0.950241 C\n0.474462 0.077318 0.667249 C\n0.416911 0.475718 0.073356 C\n0.916919 0.975718 0.573356 C\n0.189371 0.334539 0.712168 C\n0.689359 0.834539 0.212161 C\n0.974449 0.577316 0.167244 C\n0.077786 0.267349 0.965521 C\n0.577789 0.767351 0.465514 C\n0.159221 0.460420 0.158583 C\n0.659231 0.960420 0.658584 C\n0.262550 0.258688 0.848630 C\n0.762546 0.758690 0.348620 C\n0.320104 0.852581 0.450237 C\n0.118534 0.703159 0.722799 S\n0.618528 0.203162 0.222805 S\n0.368508 0.335684 0.590289 O\n0.868487 0.835681 0.090281 O\n",
"nsites": 46,
"nelements": 4,
"elements": [
"H",
"C",
"S",
"O"
],
"chemical_system": "C-H-O-S",
"density": 1.4657174486304079,
"density_atomic": 0.09564152087360846,
"volume": 480.9626570115882,
"volume_molar": 6.2965756974508365,
"formula_full": "H16 C26 S2 O2",
"formula_reduced": "H8C13SO",
"formula_anonymous": "ABC8D13",
"energy_above_hull": 5.718632760869565,
"spacegroup": 5
},
{
"id": "jvasp-31829",
"created_at": "2022-09-04T14:38:01.345087Z",
"updated_at": "2022-09-04T14:38:01.345102Z",
"structure_string": "Co1 Sn1 H12 O6 F6\n1.0\n6.471602 0.089035 -0.692306\n-0.779639 6.425085 -0.692307\n0.077798 0.089036 6.508062\nCo Sn H O F\n1 1 12 6 6\ndirect\n0.500001 0.500000 0.500000 Co\n0.000000 0.000000 0.000000 Sn\n0.347094 0.182599 0.695404 H\n0.695404 0.347093 0.182597 H\n0.182599 0.695404 0.347094 H\n0.304596 0.652907 0.817401 H\n0.817401 0.304595 0.652907 H\n0.687723 0.899162 0.545508 H\n0.454491 0.312277 0.100838 H\n0.100838 0.454490 0.312277 H\n0.312277 0.100839 0.454491 H\n0.545509 0.687725 0.899161 H\n0.899161 0.545511 0.687722 H\n0.652906 0.817403 0.304594 H\n0.602672 0.799330 0.440789 O\n0.559210 0.397328 0.200671 O\n0.397328 0.200672 0.559209 O\n0.440790 0.602672 0.799329 O\n0.200670 0.559211 0.397328 O\n0.799330 0.440791 0.602671 O\n0.865851 0.062814 0.726023 F\n0.062813 0.726023 0.865850 F\n0.726023 0.865850 0.062812 F\n0.134148 0.937187 0.273975 F\n0.273977 0.134149 0.937188 F\n0.937187 0.273977 0.134148 F\n",
"nsites": 26,
"nelements": 5,
"elements": [
"Co",
"Sn",
"H",
"O",
"F"
],
"chemical_system": "Co-F-H-O-Sn",
"density": 2.4416470656913845,
"density_atomic": 0.09564130814111793,
"volume": 271.8490629763995,
"volume_molar": 6.296589702761471,
"formula_full": "Co1 Sn1 H12 O6 F6",
"formula_reduced": "CoSnH12(OF)6",
"formula_anonymous": "ABC6D6E12",
"energy_above_hull": 2.3152767421153846,
"spacegroup": 148
},
{
"id": "jvasp-92175",
"created_at": "2022-09-04T14:35:41.702412Z",
"updated_at": "2022-09-04T14:35:41.702440Z",
"structure_string": "Cr2 Co6\n1.0\n0.000000 -0.000000 -3.944118\n-2.474373 -4.285725 -0.000000\n-2.474373 4.285725 0.000000\nCr Co\n2 6\ndirect\n0.750000 0.666670 0.333329 Cr\n0.250000 0.333329 0.666670 Cr\n0.750000 0.166036 0.332073 Co\n0.750000 0.166031 0.833968 Co\n0.750000 0.667926 0.833963 Co\n0.250000 0.833963 0.667926 Co\n0.250000 0.833968 0.166031 Co\n0.250000 0.332073 0.166036 Co\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Cr",
"Co"
],
"chemical_system": "Co-Cr",
"density": 9.083590738982798,
"density_atomic": 0.09563582819368452,
"volume": 83.6506584519576,
"volume_molar": 6.296950498304654,
"formula_full": "Cr2 Co6",
"formula_reduced": "CrCo3",
"formula_anonymous": "AB3",
"energy_above_hull": 3.649175025,
"spacegroup": 194
},
{
"id": "jvasp-43340",
"created_at": "2022-09-04T14:35:55.955755Z",
"updated_at": "2022-09-04T14:35:55.955781Z",
"structure_string": "Li4 Fe3 Ni2 Sn3 O16\n1.0\n5.969548 0.009510 -0.053372\n2.983538 5.170483 -0.053248\n0.076313 0.043646 9.493698\nLi Fe Ni Sn O\n4 3 2 3 16\ndirect\n0.679044 0.679078 0.886253 Li\n0.967903 0.967902 0.990727 Li\n0.980243 0.980244 0.502718 Li\n0.341736 0.341766 0.397935 Li\n0.830515 0.830536 0.215629 Fe\n0.177571 0.660502 0.713497 Fe\n0.660478 0.177595 0.713495 Fe\n0.667786 0.667809 0.494271 Ni\n0.335504 0.335527 0.984972 Ni\n0.170432 0.170463 0.713524 Sn\n0.337851 0.833903 0.213171 Sn\n0.833879 0.337870 0.213168 Sn\n0.155212 0.155234 0.084191 O\n0.145180 0.672054 0.104547 O\n0.344932 0.344956 0.604560 O\n0.501898 0.048377 0.838308 O\n0.048350 0.501925 0.838308 O\n0.837250 0.837268 0.616924 O\n0.968565 0.535309 0.339087 O\n0.520675 0.520695 0.348627 O\n0.824294 0.316775 0.599192 O\n0.991398 0.991423 0.809090 O\n0.989722 0.989744 0.319124 O\n0.677434 0.677457 0.096636 O\n0.487766 0.487792 0.827062 O\n0.316754 0.824318 0.599196 O\n0.535285 0.968592 0.339086 O\n0.672041 0.145193 0.104542 O\n",
"nsites": 28,
"nelements": 5,
"elements": [
"Li",
"Fe",
"Ni",
"Sn",
"O"
],
"chemical_system": "Fe-Li-Ni-O-Sn",
"density": 5.245052223291334,
"density_atomic": 0.09563305243926297,
"volume": 292.7858024586525,
"volume_molar": 6.297133267626998,
"formula_full": "Li4 Fe3 Ni2 Sn3 O16",
"formula_reduced": "Li4Fe3Ni2Sn3O16",
"formula_anonymous": "A2B3C3D4E16",
"energy_above_hull": 2.463212585714285,
"spacegroup": 8
}
]
}