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=602",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-nelements&page=600",
"results": [
{
"id": "jvasp-52335",
"created_at": "2022-09-04T14:37:13.686647Z",
"updated_at": "2022-09-04T14:37:13.686663Z",
"structure_string": "Li4 Ti4 Si4 O16\n1.0\n0.000000 4.774897 -0.002056\n10.306817 0.000000 0.000000\n0.000000 -0.002289 -5.887624\nLi Ti Si O\n4 4 4 16\ndirect\n0.750014 0.703010 0.250089 Li\n0.250031 0.202905 0.249965 Li\n0.749969 0.702905 0.750035 Li\n0.249986 0.203010 0.749911 Li\n0.746845 0.976457 0.999978 Ti\n0.246838 0.929408 0.499991 Ti\n0.753162 0.429408 0.500009 Ti\n0.253155 0.476457 0.000022 Ti\n0.807964 0.295673 0.000007 Si\n0.307960 0.610184 0.500012 Si\n0.692041 0.110184 0.499988 Si\n0.192037 0.795673 -0.000006 Si\n0.039106 0.875478 0.785114 O\n0.960911 0.375473 0.785122 O\n0.460899 0.530385 0.714893 O\n0.555386 0.255999 0.500012 O\n0.968931 0.605626 0.500041 O\n0.539116 0.030375 0.714868 O\n0.460884 0.530375 0.285132 O\n0.531062 0.800249 0.000004 O\n0.444614 0.755999 0.499988 O\n0.539102 0.030385 0.285107 O\n0.039090 0.875473 0.214878 O\n0.960895 0.375478 0.214886 O\n0.468938 0.300249 -0.000004 O\n0.055391 0.649860 0.000005 O\n0.031069 0.105626 0.499959 O\n0.944609 0.149860 -0.000005 O\n",
"nsites": 28,
"nelements": 4,
"elements": [
"Li",
"Ti",
"Si",
"O"
],
"chemical_system": "Li-O-Si-Ti",
"density": 3.3672538589214245,
"density_atomic": 0.09663385803537432,
"volume": 289.7535146506328,
"volume_molar": 6.231915896181546,
"formula_full": "Li4 Ti4 Si4 O16",
"formula_reduced": "LiTiSiO4",
"formula_anonymous": "ABCD4",
"energy_above_hull": 2.412024419047619,
"spacegroup": 62
},
{
"id": "jvasp-28720",
"created_at": "2022-09-04T14:37:11.917961Z",
"updated_at": "2022-09-04T14:37:11.917978Z",
"structure_string": "Mo3 W1 Se2 S6\n1.0\n3.223342 -0.000000 0.000001\n-1.611671 2.791512 -0.000011\n0.000012 -0.000117 34.087658\nMo W Se S\n3 1 2 6\ndirect\n0.333317 0.666636 0.093463 Mo\n0.666668 0.333336 0.282457 Mo\n0.666676 0.333353 0.654868 Mo\n0.333337 0.666671 0.472126 W\n0.333334 0.666666 0.332643 Se\n0.333338 0.666676 0.232270 Se\n0.333346 0.666696 0.700494 S\n0.666641 0.333290 0.047842 S\n0.666673 0.333335 0.426206 S\n0.666657 0.333313 0.139143 S\n0.666668 0.333339 0.518029 S\n0.333341 0.666681 0.609206 S\n",
"nsites": 12,
"nelements": 4,
"elements": [
"Mo",
"W",
"Se",
"S"
],
"chemical_system": "Mo-S-Se-W",
"density": 4.4500205283723036,
"density_atomic": 0.03912354467828553,
"volume": 306.7206741791031,
"volume_molar": 15.392625615905473,
"formula_full": "Mo3 W1 Se2 S6",
"formula_reduced": "Mo3W(SeS3)2",
"formula_anonymous": "AB2C3D6",
"energy_above_hull": 4.000984536111112,
"spacegroup": 156
},
{
"id": "jvasp-57437",
"created_at": "2022-09-04T14:37:28.044373Z",
"updated_at": "2022-09-04T14:37:28.044391Z",
"structure_string": "Y4 C2 N4 O4\n1.0\n1.856669 -3.215845 -0.000000\n1.856669 3.215845 -0.000000\n-0.000000 -0.000000 16.456862\nY C N O\n4 2 4 4\ndirect\n0.333334 0.666667 0.411193 Y\n0.666667 0.333334 0.911193 Y\n0.333334 0.666667 0.088807 Y\n0.666667 0.333334 0.588807 Y\n0.000000 0.000000 0.250000 C\n0.000000 0.000000 0.750000 C\n0.000000 0.000000 0.675032 N\n0.000000 0.000000 0.175032 N\n0.000000 0.000000 0.824968 N\n0.000000 0.000000 0.324968 N\n0.333334 0.666667 0.948403 O\n0.666667 0.333334 0.051597 O\n0.666667 0.333334 0.448403 O\n0.333334 0.666667 0.551597 O\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Y",
"C",
"N",
"O"
],
"chemical_system": "C-N-O-Y",
"density": 4.2220664097149925,
"density_atomic": 0.07123959114674552,
"volume": 196.51993750443597,
"volume_molar": 8.453362327129405,
"formula_full": "Y4 C2 N4 O4",
"formula_reduced": "Y2C(NO)2",
"formula_anonymous": "AB2C2D2",
"energy_above_hull": 4.0581492,
"spacegroup": 194
},
{
"id": "jvasp-28908",
"created_at": "2022-09-04T14:37:13.711821Z",
"updated_at": "2022-09-04T14:37:13.711845Z",
"structure_string": "Te2 W4 Se4 S2\n1.0\n3.347321 -0.000000 -0.000000\n-1.673661 2.898884 0.000056\n-0.000000 0.001668 36.133835\nTe W Se S\n2 4 4 2\ndirect\n0.666681 0.333362 0.415211 Te\n0.666636 0.333271 0.521012 Te\n0.333312 0.666624 0.098512 W\n0.333330 0.666661 0.468126 W\n0.666671 0.333340 0.274759 W\n0.666684 0.333369 0.661546 W\n0.333336 0.666672 0.321123 Se\n0.333351 0.666702 0.707858 Se\n0.333349 0.666700 0.228391 Se\n0.333364 0.666729 0.615158 Se\n0.666666 0.333331 0.056326 S\n0.666618 0.333235 0.140727 S\n",
"nsites": 12,
"nelements": 4,
"elements": [
"Te",
"W",
"Se",
"S"
],
"chemical_system": "S-Se-Te-W",
"density": 6.490757559018947,
"density_atomic": 0.03422464798840231,
"volume": 350.624497410943,
"volume_molar": 17.595917310941285,
"formula_full": "Te2 W4 Se4 S2",
"formula_reduced": "TeW2Se2S",
"formula_anonymous": "ABC2D2",
"energy_above_hull": 3.90732075,
"spacegroup": 156
},
{
"id": "jvasp-10544",
"created_at": "2022-09-04T14:37:07.653547Z",
"updated_at": "2022-09-04T14:37:07.653566Z",
"structure_string": "K4 Na2 Ga2 As4\n1.0\n-6.604993 0.000582 -0.001334\n-0.000858 -6.696232 -0.002794\n3.301398 3.344788 7.445909\nK Na Ga As\n4 2 2 4\ndirect\n0.326865 0.586386 0.653724 K\n0.826878 0.067349 0.653736 K\n0.173122 0.932651 0.346265 K\n0.673135 0.413614 0.346277 K\n0.749994 0.000002 -0.000004 Na\n0.250006 -0.000001 0.000005 Na\n0.250000 0.500001 -0.000002 Ga\n0.750000 0.500000 0.000003 Ga\n0.596959 0.802048 0.193906 As\n0.403041 0.197953 0.806095 As\n0.903053 0.608158 0.806098 As\n0.096947 0.391842 0.193903 As\n",
"nsites": 12,
"nelements": 4,
"elements": [
"K",
"Na",
"Ga",
"As"
],
"chemical_system": "As-Ga-K-Na",
"density": 3.235556329266413,
"density_atomic": 0.036448610283415346,
"volume": 329.23065945974287,
"volume_molar": 16.522278114784974,
"formula_full": "K4 Na2 Ga2 As4",
"formula_reduced": "K2NaGaAs2",
"formula_anonymous": "ABC2D2",
"energy_above_hull": 0.207548470833333,
"spacegroup": 72
},
{
"id": "jvasp-55536",
"created_at": "2022-09-04T14:37:13.649284Z",
"updated_at": "2022-09-04T14:37:13.649313Z",
"structure_string": "Dy4 Be4 Ge2 O14\n1.0\n7.434175 0.000000 0.000000\n0.000000 7.434175 0.000000\n0.000000 -0.000000 4.810873\nDy Be Ge O\n4 4 2 14\ndirect\n0.658001 0.841998 0.505015 Dy\n0.158001 0.658001 0.494984 Dy\n0.841998 0.341998 0.494984 Dy\n0.341998 0.158001 0.505015 Dy\n0.364542 0.864542 0.048416 Be\n0.864542 0.635457 0.951583 Be\n0.635457 0.135457 0.048416 Be\n0.135457 0.364542 0.951583 Be\n0.500000 0.500000 0.000000 Ge\n0.000000 0.000000 0.000000 Ge\n0.857630 0.642369 0.282127 O\n0.357631 0.857630 0.717872 O\n0.642369 0.142369 0.717872 O\n0.142369 0.357631 0.282127 O\n0.500000 0.000000 0.185738 O\n0.000000 0.500000 0.814262 O\n0.172002 0.918795 0.218936 O\n0.327997 0.418795 0.781063 O\n0.418795 0.672002 0.218936 O\n0.581205 0.327997 0.218936 O\n0.081205 0.172002 0.781063 O\n0.918795 0.827997 0.781063 O\n0.672002 0.581205 0.781063 O\n0.827997 0.081205 0.218936 O\n",
"nsites": 24,
"nelements": 4,
"elements": [
"Dy",
"Be",
"Ge",
"O"
],
"chemical_system": "Be-Dy-Ge-O",
"density": 6.590888257474678,
"density_atomic": 0.0902654993686279,
"volume": 265.8823157005797,
"volume_molar": 6.671586378098538,
"formula_full": "Dy4 Be4 Ge2 O14",
"formula_reduced": "Dy2Be2GeO7",
"formula_anonymous": "AB2C2D7",
"energy_above_hull": 2.1976429708333334,
"spacegroup": 113
},
{
"id": "jvasp-85184",
"created_at": "2022-09-04T14:37:08.655872Z",
"updated_at": "2022-09-04T14:37:08.655893Z",
"structure_string": "La1 Al2 B1 Ru2\n1.0\n4.234605 0.000000 0.000000\n0.000000 4.234605 0.000000\n0.000000 0.000000 5.681263\nLa Al B Ru\n1 2 1 2\ndirect\n0.000000 0.000000 0.500000 La\n0.500001 0.500001 0.745733 Al\n0.500001 0.500001 0.254266 Al\n0.000000 0.000000 0.000000 B\n0.500001 0.000000 0.000000 Ru\n0.000000 0.500001 0.000000 Ru\n",
"nsites": 6,
"nelements": 4,
"elements": [
"La",
"Al",
"B",
"Ru"
],
"chemical_system": "Al-B-La-Ru",
"density": 6.614718291857007,
"density_atomic": 0.05889528722298426,
"volume": 101.87572355803813,
"volume_molar": 10.225165788222562,
"formula_full": "La1 Al2 B1 Ru2",
"formula_reduced": "LaAl2BRu2",
"formula_anonymous": "ABC2D2",
"energy_above_hull": 3.356662363888889,
"spacegroup": 123
},
{
"id": "jvasp-57246",
"created_at": "2022-09-04T14:37:11.931247Z",
"updated_at": "2022-09-04T14:37:11.931266Z",
"structure_string": "Na3 Co2 Sb1 O6\n1.0\n5.352128 0.036145 0.009503\n-2.633027 4.659547 0.004498\n-0.905675 -1.558007 5.348651\nNa Co Sb O\n3 2 1 6\ndirect\n0.176329 0.823664 0.500000 Na\n0.823671 0.176335 0.500000 Na\n0.500001 0.499999 0.500000 Na\n0.661732 0.338221 0.000003 Co\n0.338267 0.661778 -0.000004 Co\n-0.000003 -0.000002 -0.000003 Sb\n0.067163 0.386482 0.206647 O\n0.613532 0.932858 0.793344 O\n0.386470 0.067142 0.206657 O\n0.932838 0.613518 0.793354 O\n0.246164 0.246176 0.790470 O\n0.753837 0.753823 0.209530 O\n",
"nsites": 12,
"nelements": 4,
"elements": [
"Na",
"Co",
"Sb",
"O"
],
"chemical_system": "Co-Na-O-Sb",
"density": 5.0132608553409055,
"density_atomic": 0.08954370401915256,
"volume": 134.0127721032549,
"volume_molar": 6.725364810363352,
"formula_full": "Na3 Co2 Sb1 O6",
"formula_reduced": "Na3Co2SbO6",
"formula_anonymous": "AB2C3D6",
"energy_above_hull": 1.962914658333333,
"spacegroup": 12
},
{
"id": "jvasp-27674",
"created_at": "2022-09-04T14:37:28.491050Z",
"updated_at": "2022-09-04T14:37:28.491059Z",
"structure_string": "Mg2 Sn2 Ge4 O12\n1.0\n5.197004 -0.274653 0.865179\n1.052122 7.026315 0.348148\n-0.459401 -0.336348 7.090352\nMg Sn Ge O\n2 2 4 12\ndirect\n0.750000 0.299055 0.700945 Mg\n0.250000 0.700944 0.299056 Mg\n0.749999 0.886138 0.113862 Sn\n0.250000 0.113861 0.886139 Sn\n0.795108 0.400362 0.202297 Ge\n0.704891 0.797703 0.599639 Ge\n0.204891 0.599638 0.797704 Ge\n0.295108 0.202296 0.400362 Ge\n0.644064 0.019050 0.712032 O\n0.855935 0.287968 0.980950 O\n0.606044 0.615848 0.185397 O\n0.893954 0.814603 0.384152 O\n0.393955 0.384151 0.814603 O\n0.887227 0.596273 0.708160 O\n0.112773 0.403726 0.291841 O\n0.387227 0.708159 0.596274 O\n0.144064 0.712032 0.019051 O\n0.612772 0.291841 0.403726 O\n0.106045 0.185396 0.615848 O\n0.355936 0.980949 0.287968 O\n",
"nsites": 20,
"nelements": 4,
"elements": [
"Mg",
"Sn",
"Ge",
"O"
],
"chemical_system": "Ge-Mg-O-Sn",
"density": 4.832536408260755,
"density_atomic": 0.07572954921298838,
"volume": 264.0977030478586,
"volume_molar": 7.952167710734427,
"formula_full": "Mg2 Sn2 Ge4 O12",
"formula_reduced": "MgSn(GeO3)2",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 1.683948365,
"spacegroup": 15
},
{
"id": "jvasp-9350",
"created_at": "2022-09-04T14:37:07.654868Z",
"updated_at": "2022-09-04T14:37:07.654889Z",
"structure_string": "Ba2 Al1 Ag3 O8\n1.0\n4.000770 0.000000 0.000000\n0.000000 4.000770 0.000000\n0.000000 0.000000 12.310419\nBa Al Ag O\n2 1 3 8\ndirect\n0.500000 0.500000 0.162343 Ba\n0.500000 0.500000 0.837672 Ba\n0.500000 0.500000 0.499998 Al\n0.000000 0.000000 0.358850 Ag\n0.000000 0.000000 0.000001 Ag\n0.000000 0.000000 0.641145 Ag\n0.000000 0.500000 0.402558 O\n0.500000 0.000000 0.402558 O\n0.500000 0.000000 0.000009 O\n0.000000 0.000000 0.171164 O\n0.000000 0.500000 0.597429 O\n0.500000 0.000000 0.597429 O\n0.000000 0.000000 0.828839 O\n0.000000 0.500000 0.000009 O\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Ba",
"Al",
"Ag",
"O"
],
"chemical_system": "Ag-Al-Ba-O",
"density": 6.347749496121624,
"density_atomic": 0.07105064598107469,
"volume": 197.04254347988746,
"volume_molar": 8.475842375316445,
"formula_full": "Ba2 Al1 Ag3 O8",
"formula_reduced": "Ba2AlAg3O8",
"formula_anonymous": "AB2C3D8",
"energy_above_hull": 1.6480460371428571,
"spacegroup": 123
},
{
"id": "jvasp-10974",
"created_at": "2022-09-04T14:37:13.598271Z",
"updated_at": "2022-09-04T14:37:13.598297Z",
"structure_string": "Sr2 Ta1 Ga1 O6\n1.0\n4.847377 -0.000000 -2.796247\n-1.613037 4.571124 -2.796248\n0.016713 0.023622 5.628632\nSr Ta Ga O\n2 1 1 6\ndirect\n0.249999 0.749999 0.499999 Sr\n0.750000 0.250000 0.499999 Sr\n0.500000 0.500000 -0.000001 Ta\n0.000000 0.000000 0.000000 Ga\n0.716158 0.783382 0.999998 O\n0.216616 0.716158 -0.000001 O\n0.783383 0.283841 0.999999 O\n0.283841 0.216617 -0.000000 O\n0.250652 0.250652 0.501304 O\n0.749347 0.749346 0.498694 O\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Sr",
"Ta",
"Ga",
"O"
],
"chemical_system": "Ga-O-Sr-Ta",
"density": 6.913304213766299,
"density_atomic": 0.07977066559866577,
"volume": 125.35936518708523,
"volume_molar": 7.54931742740871,
"formula_full": "Sr2 Ta1 Ga1 O6",
"formula_reduced": "Sr2TaGaO6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 2.0475125145000006,
"spacegroup": 87
},
{
"id": "jvasp-48641",
"created_at": "2022-09-04T14:37:08.270153Z",
"updated_at": "2022-09-04T14:37:08.270168Z",
"structure_string": "Li3 Mn5 O1 F11\n1.0\n-5.231648 0.055951 0.736701\n2.414406 4.811970 -1.672192\n1.181901 -0.320606 -9.322445\nLi Mn O F\n3 5 1 11\ndirect\n0.513215 0.532226 0.497011 Li\n0.767926 0.259581 0.256304 Li\n0.299346 0.805024 0.775598 Li\n0.441936 0.710480 0.147754 Mn\n0.986448 0.014686 -0.000221 Mn\n0.947952 0.265934 0.637680 Mn\n0.209962 0.988032 0.410901 Mn\n0.667474 0.504569 0.893120 Mn\n0.567341 0.763107 0.953135 O\n0.402313 0.512622 0.682796 F\n0.048372 0.260395 0.440960 F\n-0.004155 0.576507 0.110821 F\n0.956628 0.379039 0.847965 F\n0.447521 0.832471 0.350821 F\n0.433932 0.147699 0.052766 F\n0.031421 0.931471 0.792758 F\n0.523804 0.385271 0.310066 F\n0.913500 0.012868 0.209584 F\n0.921201 0.652888 0.542373 F\n0.498499 0.089526 0.612689 F\n",
"nsites": 20,
"nelements": 4,
"elements": [
"Li",
"Mn",
"O",
"F"
],
"chemical_system": "F-Li-Mn-O",
"density": 3.695468807182653,
"density_atomic": 0.0855133315969709,
"volume": 233.8816606311296,
"volume_molar": 7.042341407516064,
"formula_full": "Li3 Mn5 O1 F11",
"formula_reduced": "Li3Mn5OF11",
"formula_anonymous": "AB3C5D11",
"energy_above_hull": 1.3965186407198271,
"spacegroup": 1
}
]
}