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=nelements&page=3999",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=nelements&page=3997",
"results": [
{
"id": "jvasp-46255",
"created_at": "2022-09-04T14:38:05.353549Z",
"updated_at": "2022-09-04T14:38:05.353570Z",
"structure_string": "Li6 Cr2 Cl2 O8\n1.0\n6.732671 0.000000 0.000000\n0.000000 6.732671 -0.000000\n0.000000 -0.000000 4.790677\nLi Cr Cl O\n6 2 2 8\ndirect\n0.500000 0.000000 0.156735 Li\n0.750000 0.250000 0.500000 Li\n0.250000 0.250000 0.500000 Li\n0.000000 0.500000 0.843265 Li\n0.250000 0.750000 0.500000 Li\n0.750000 0.750000 0.500000 Li\n0.000000 0.000000 0.000000 Cr\n0.500000 0.500000 0.000000 Cr\n0.000000 0.500000 0.321640 Cl\n0.500000 0.000000 0.678360 Cl\n0.196562 0.000000 0.210698 O\n0.803438 0.000000 0.210698 O\n0.000000 0.196562 0.789303 O\n0.500000 0.303438 0.210698 O\n0.303438 0.500000 0.789303 O\n0.696562 0.500000 0.789303 O\n0.500000 0.696562 0.210698 O\n0.000000 0.803438 0.789303 O\n",
"nsites": 18,
"nelements": 4,
"elements": [
"Li",
"Cr",
"Cl",
"O"
],
"chemical_system": "Cl-Cr-Li-O",
"density": 2.6346098709099235,
"density_atomic": 0.08288974988758407,
"volume": 217.15592126181807,
"volume_molar": 7.265241803923029,
"formula_full": "Li6 Cr2 Cl2 O8",
"formula_reduced": "Li3CrClO4",
"formula_anonymous": "ABC3D4",
"energy_above_hull": 1.9469172741666676,
"spacegroup": 129
},
{
"id": "jvasp-47054",
"created_at": "2022-09-04T14:38:08.182000Z",
"updated_at": "2022-09-04T14:38:08.182027Z",
"structure_string": "Li2 Fe1 Ni1 O4\n1.0\n4.991119 -0.244653 0.000000\n1.964381 4.594816 0.000000\n-3.477750 -2.175081 2.854015\nLi Fe Ni O\n2 1 1 4\ndirect\n0.250000 0.750001 0.500001 Li\n0.500000 0.500001 -0.000000 Li\n0.750000 0.250001 0.500001 Fe\n0.000000 0.000000 0.000000 Ni\n0.519991 0.019992 0.500001 O\n0.235270 0.235271 -0.000000 O\n0.980009 0.480011 0.500001 O\n0.764729 0.764731 -0.000000 O\n",
"nsites": 8,
"nelements": 4,
"elements": [
"Li",
"Fe",
"Ni",
"O"
],
"chemical_system": "Fe-Li-Ni-O",
"density": 4.781513978648869,
"density_atomic": 0.11971832254895921,
"volume": 66.8235223286592,
"volume_molar": 5.030258219277358,
"formula_full": "Li2 Fe1 Ni1 O4",
"formula_reduced": "Li2FeNiO4",
"formula_anonymous": "ABC2D4",
"energy_above_hull": 2.0550252375,
"spacegroup": 119
},
{
"id": "jvasp-23047",
"created_at": "2022-09-04T14:38:06.439965Z",
"updated_at": "2022-09-04T14:38:06.439996Z",
"structure_string": "Sr6 Yb2 Rh2 O12\n1.0\n6.772907 0.025505 -0.234436\n-0.243570 6.768574 -0.234436\n0.024512 0.025505 6.776919\nYb Sr Rh O\n2 6 2 12\ndirect\n0.250000 0.250000 0.250000 Yb\n0.750000 0.750001 0.749999 Yb\n0.750000 0.384174 0.115826 Sr\n0.115826 0.750000 0.384173 Sr\n0.384174 0.115827 0.750000 Sr\n0.884174 0.250001 0.615826 Sr\n0.250000 0.615827 0.884173 Sr\n0.615827 0.884174 0.249999 Sr\n0.000000 0.000000 0.000000 Rh\n0.500000 0.500000 0.499999 Rh\n0.084188 0.286305 0.951489 O\n0.786305 0.584189 0.451489 O\n0.548511 0.213696 0.415812 O\n0.415812 0.548511 0.213695 O\n0.213696 0.415812 0.548510 O\n0.713696 0.048512 0.915812 O\n0.915812 0.713696 0.048510 O\n0.048511 0.915812 0.713695 O\n0.451489 0.786305 0.584187 O\n0.584188 0.451490 0.786304 O\n0.951490 0.084189 0.286304 O\n0.286305 0.951489 0.084187 O\n",
"nsites": 22,
"nelements": 4,
"elements": [
"Yb",
"Sr",
"Rh",
"O"
],
"chemical_system": "O-Rh-Sr-Yb",
"density": 6.783301011673562,
"density_atomic": 0.07078585126517743,
"volume": 310.7965731397898,
"volume_molar": 8.507548687152042,
"formula_full": "Sr6 Yb2 Rh2 O12",
"formula_reduced": "Sr3YbRhO6",
"formula_anonymous": "ABC3D6",
"energy_above_hull": 1.3917085118181816,
"spacegroup": 167
},
{
"id": "jvasp-44373",
"created_at": "2022-09-04T14:38:08.672899Z",
"updated_at": "2022-09-04T14:38:08.672915Z",
"structure_string": "Li4 Al2 Fe2 O8\n1.0\n4.996034 0.000808 0.000290\n-0.001063 5.413930 0.000275\n-0.004447 -0.000244 6.333841\nLi Al Fe O\n4 2 2 8\ndirect\n0.501132 0.668706 0.749779 Li\n0.001188 0.833014 0.502021 Li\n0.001153 0.330733 0.249786 Li\n0.501208 0.166421 0.002009 Li\n0.996080 0.832642 0.000313 Al\n0.496083 0.166793 0.500306 Al\n0.997844 0.333384 0.752614 Fe\n0.497836 0.666050 0.252612 Fe\n0.102662 0.146404 0.992684 O\n0.103685 0.668468 0.770807 O\n0.618920 0.317479 0.731891 O\n0.138410 0.178764 0.509341 O\n0.602653 0.853035 0.492678 O\n0.603689 0.330974 0.270796 O\n0.118913 0.681960 0.231901 O\n0.638405 0.820675 0.009337 O\n",
"nsites": 16,
"nelements": 4,
"elements": [
"Li",
"Al",
"Fe",
"O"
],
"chemical_system": "Al-Fe-Li-O",
"density": 3.1153464354206064,
"density_atomic": 0.09339309584656058,
"volume": 171.3188737879197,
"volume_molar": 6.448164829972042,
"formula_full": "Li4 Al2 Fe2 O8",
"formula_reduced": "Li2AlFeO4",
"formula_anonymous": "ABC2D4",
"energy_above_hull": 2.0591165375,
"spacegroup": 7
},
{
"id": "jvasp-28804",
"created_at": "2022-09-04T14:38:03.118205Z",
"updated_at": "2022-09-04T14:38:03.118238Z",
"structure_string": "Te2 Mo3 W1 S6\n1.0\n3.276081 0.000000 -0.000000\n-1.638041 2.836959 -0.000545\n-0.000000 -0.007517 38.477884\nTe Mo W S\n2 3 1 6\ndirect\n0.333621 0.667242 0.709363 Te\n0.333418 0.666836 0.609389 Te\n0.333383 0.666765 0.093500 Mo\n0.666724 0.333449 0.282072 Mo\n0.666875 0.333751 0.659446 Mo\n0.333024 0.666048 0.467926 W\n0.333512 0.667026 0.322012 S\n0.666595 0.333190 0.053649 S\n0.666282 0.332566 0.427784 S\n0.666856 0.333711 0.133412 S\n0.666450 0.332901 0.508072 S\n0.333256 0.666513 0.242126 S\n",
"nsites": 12,
"nelements": 4,
"elements": [
"Te",
"Mo",
"W",
"S"
],
"chemical_system": "Mo-S-Te-W",
"density": 4.268387907818761,
"density_atomic": 0.03355539773691535,
"volume": 357.61757598833117,
"volume_molar": 17.946861507097722,
"formula_full": "Te2 Mo3 W1 S6",
"formula_reduced": "Te2Mo3WS6",
"formula_anonymous": "AB2C3D6",
"energy_above_hull": 3.918652769444444,
"spacegroup": 156
},
{
"id": "jvasp-29543",
"created_at": "2022-09-04T14:38:01.590556Z",
"updated_at": "2022-09-04T14:38:01.590583Z",
"structure_string": "Cd2 Sb4 Se6 Br4\n1.0\n4.028155 -0.000000 0.700091\n1.297396 9.728539 4.473659\n0.025315 -0.011317 11.792903\nCd Sb Se Br\n2 4 6 4\ndirect\n0.350683 0.846438 0.452196 Cd\n0.649318 0.153562 0.547803 Cd\n0.046400 0.688081 0.219121 Sb\n0.953601 0.311919 0.780879 Sb\n0.704923 0.683667 0.906487 Sb\n0.295078 0.316333 0.093513 Sb\n0.460656 0.864109 0.214582 Se\n0.900274 0.172034 0.027421 Se\n0.539345 0.135891 0.785417 Se\n0.678201 0.503410 0.140192 Se\n0.099727 0.827966 0.972579 Se\n0.321800 0.496590 0.859808 Se\n0.101987 0.342103 0.453922 Br\n0.898014 0.657897 0.546078 Br\n0.213496 0.923419 0.649590 Br\n0.786505 0.076581 0.350410 Br\n",
"nsites": 16,
"nelements": 4,
"elements": [
"Cd",
"Sb",
"Se",
"Br"
],
"chemical_system": "Br-Cd-Sb-Se",
"density": 5.408287678178538,
"density_atomic": 0.034619875054783415,
"volume": 462.16226877425675,
"volume_molar": 17.395038978247044,
"formula_full": "Cd2 Sb4 Se6 Br4",
"formula_reduced": "CdSb2Se3Br2",
"formula_anonymous": "AB2C2D3",
"energy_above_hull": 0.7118487825000002,
"spacegroup": 12
},
{
"id": "jvasp-49227",
"created_at": "2022-09-04T14:38:11.403189Z",
"updated_at": "2022-09-04T14:38:11.403236Z",
"structure_string": "K3 Nb3 B2 O12\n1.0\n4.459456 -7.724006 -0.000000\n4.459456 7.724006 0.000000\n-0.000000 0.000000 3.955673\nK Nb B O\n3 3 2 12\ndirect\n0.000000 0.595659 0.500000 K\n0.404341 0.404341 0.500000 K\n0.595659 0.000000 0.500000 K\n0.000000 0.247489 0.000000 Nb\n0.752512 0.752512 0.000000 Nb\n0.247489 0.000000 0.000000 Nb\n0.666668 0.333333 0.000000 B\n0.333333 0.666668 0.000000 B\n0.000000 0.819758 0.000000 O\n0.264807 0.000000 0.500000 O\n0.735194 0.735194 0.500000 O\n0.000000 0.264807 0.500000 O\n0.188195 0.505217 0.000000 O\n0.811806 0.317022 0.000000 O\n0.682979 0.494784 0.000000 O\n0.505217 0.188195 0.000000 O\n0.180243 0.180243 0.000000 O\n0.317022 0.811806 0.000000 O\n0.494784 0.682979 0.000000 O\n0.819758 0.000000 0.000000 O\n",
"nsites": 20,
"nelements": 4,
"elements": [
"K",
"Nb",
"B",
"O"
],
"chemical_system": "B-K-Nb-O",
"density": 3.7148367844904735,
"density_atomic": 0.07339308299245963,
"volume": 272.50524415297815,
"volume_molar": 8.205324690637008,
"formula_full": "K3 Nb3 B2 O12",
"formula_reduced": "K3Nb3(BO6)2",
"formula_anonymous": "A2B3C3D12",
"energy_above_hull": 3.1283584683333334,
"spacegroup": 189
},
{
"id": "jvasp-47337",
"created_at": "2022-09-04T14:38:05.346961Z",
"updated_at": "2022-09-04T14:38:05.346982Z",
"structure_string": "Li2 Fe2 Si1 O6\n1.0\n5.274044 0.000000 0.000000\n-2.637022 4.809374 0.000000\n0.000000 0.000000 6.081620\nLi Fe Si O\n2 2 1 6\ndirect\n0.000000 0.000000 0.286799 Li\n0.000000 0.000000 0.713201 Li\n0.000000 0.500000 0.671073 Fe\n0.500000 0.500000 0.328926 Fe\n0.500000 -0.000000 0.000000 Si\n0.216564 0.816203 0.845008 O\n0.160915 0.321827 0.500000 O\n0.599640 0.816203 0.154992 O\n0.400360 0.183796 0.154992 O\n0.839085 0.678172 0.500000 O\n0.783435 0.183796 0.845008 O\n",
"nsites": 11,
"nelements": 4,
"elements": [
"Li",
"Fe",
"Si",
"O"
],
"chemical_system": "Fe-Li-O-Si",
"density": 2.687422023656354,
"density_atomic": 0.07130846778253021,
"volume": 154.25937959495576,
"volume_molar": 8.44519724973723,
"formula_full": "Li2 Fe2 Si1 O6",
"formula_reduced": "Li2Fe2SiO6",
"formula_anonymous": "AB2C2D6",
"energy_above_hull": 2.6653427818181816,
"spacegroup": 21
},
{
"id": "jvasp-46748",
"created_at": "2022-09-04T14:38:05.197083Z",
"updated_at": "2022-09-04T14:38:05.197115Z",
"structure_string": "Li2 Fe2 Si2 O8\n1.0\n4.993035 -0.002558 -0.000209\n0.004260 5.530386 -0.001235\n0.070570 0.002301 6.082391\nLi Fe Si O\n2 2 2 8\ndirect\n0.010637 0.333685 0.749588 Li\n0.510856 0.666105 0.249626 Li\n0.009985 0.832431 0.998848 Fe\n0.509843 0.167335 0.498768 Fe\n0.005870 0.830767 0.501381 Si\n0.505804 0.169017 0.001301 Si\n0.139578 0.104229 0.521619 O\n0.121720 0.703446 0.273419 O\n0.075869 0.673132 0.724030 O\n0.177853 0.137544 0.981338 O\n0.639679 0.895557 0.021613 O\n0.575774 0.326618 0.223914 O\n0.621537 0.296337 0.773288 O\n0.677902 0.862223 0.481354 O\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Li",
"Fe",
"Si",
"O"
],
"chemical_system": "Fe-Li-O-Si",
"density": 3.0623093359731,
"density_atomic": 0.08335530144351345,
"volume": 167.9557239618075,
"volume_molar": 7.224664365326498,
"formula_full": "Li2 Fe2 Si2 O8",
"formula_reduced": "LiFeSiO4",
"formula_anonymous": "ABCD4",
"energy_above_hull": 2.441719728571429,
"spacegroup": 7
},
{
"id": "jvasp-43525",
"created_at": "2022-09-04T14:38:08.626217Z",
"updated_at": "2022-09-04T14:38:08.626244Z",
"structure_string": "Li4 V1 Cr3 O8\n1.0\n-5.026554 0.000112 -0.000841\n-0.000277 -5.807134 -0.000717\n1.681202 2.902745 4.818282\nLi V Cr O\n4 1 3 8\ndirect\n0.005295 0.752205 0.004395 Li\n0.994705 0.247793 0.995604 Li\n0.500000 0.000000 0.000000 Li\n0.500000 0.500000 -0.000000 Li\n0.500000 0.499999 0.500000 V\n-0.000006 0.252994 0.500003 Cr\n0.000006 0.747004 0.499996 Cr\n0.500000 -0.000000 0.500000 Cr\n0.758984 0.382578 0.265139 O\n0.758231 0.888382 0.276745 O\n0.255583 0.132759 0.268234 O\n0.744417 0.867239 0.731765 O\n0.744414 0.364505 0.731772 O\n0.241016 0.617420 0.734860 O\n0.255586 0.635493 0.268228 O\n0.241769 0.111617 0.723254 O\n",
"nsites": 16,
"nelements": 4,
"elements": [
"Li",
"V",
"Cr",
"O"
],
"chemical_system": "Cr-Li-O-V",
"density": 4.282690858193234,
"density_atomic": 0.11377667230500035,
"volume": 140.62636633552535,
"volume_molar": 5.292948578999119,
"formula_full": "Li4 V1 Cr3 O8",
"formula_reduced": "Li4VCr3O8",
"formula_anonymous": "AB3C4D8",
"energy_above_hull": 3.038047775,
"spacegroup": 12
},
{
"id": "jvasp-46868",
"created_at": "2022-09-04T14:38:08.236434Z",
"updated_at": "2022-09-04T14:38:08.236451Z",
"structure_string": "Li1 Si2 Ni1 O6\n1.0\n5.348720 0.000037 -0.000002\n-2.674340 4.667785 0.000003\n-0.000002 0.000009 5.497262\nLi Si Ni O\n1 2 1 6\ndirect\n0.000026 -0.000001 0.000007 Li\n0.000006 0.500004 0.667670 Si\n0.500001 0.499997 0.332330 Si\n0.500027 0.000001 -0.000005 Ni\n0.152194 0.788483 0.836630 O\n0.241228 0.482513 0.499955 O\n0.636336 0.788470 0.163354 O\n0.363713 0.211518 0.163367 O\n0.758715 0.517488 0.500044 O\n0.847871 0.211533 0.836645 O\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Li",
"Si",
"Ni",
"O"
],
"chemical_system": "Li-Ni-O-Si",
"density": 2.6351278877160818,
"density_atomic": 0.07286033019888608,
"volume": 137.2488976196389,
"volume_molar": 8.265321806202945,
"formula_full": "Li1 Si2 Ni1 O6",
"formula_reduced": "LiSi2NiO6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 2.46994206,
"spacegroup": 21
},
{
"id": "jvasp-44364",
"created_at": "2022-09-04T14:38:08.664517Z",
"updated_at": "2022-09-04T14:38:08.664540Z",
"structure_string": "Li3 Mn4 Ni1 O8\n1.0\n0.061187 3.149165 -5.002554\n1.781251 -2.597717 -5.002554\n-5.138691 1.592822 -2.428324\nLi Mn Ni O\n3 4 1 8\ndirect\n-0.000000 -0.000000 0.500000 Li\n0.500000 -0.000001 0.499999 Li\n0.500000 0.499999 0.499999 Li\n-0.000001 0.500000 0.500000 Mn\n0.000000 0.000000 0.000000 Mn\n0.500000 -0.000001 -0.000000 Mn\n-0.000000 0.500000 0.000000 Mn\n0.500000 0.499999 -0.000000 Ni\n0.456974 0.250131 0.793157 O\n0.994553 0.264349 0.763408 O\n0.500941 0.757960 0.763408 O\n0.025641 0.750505 0.724862 O\n0.974358 0.249494 0.275136 O\n0.499059 0.242039 0.236591 O\n0.005446 0.735650 0.236591 O\n0.543025 0.749867 0.206842 O\n",
"nsites": 16,
"nelements": 4,
"elements": [
"Li",
"Mn",
"Ni",
"O"
],
"chemical_system": "Li-Mn-Ni-O",
"density": 4.792723741551113,
"density_atomic": 0.10808295336576915,
"volume": 148.03444485693842,
"volume_molar": 5.571776651605884,
"formula_full": "Li3 Mn4 Ni1 O8",
"formula_reduced": "Li3Mn4NiO8",
"formula_anonymous": "AB3C4D8",
"energy_above_hull": 2.959268710344827,
"spacegroup": 12
}
]
}