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&page=3856",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-density&page=3854",
"results": [
{
"id": "jvasp-44344",
"created_at": "2022-09-04T14:35:46.478536Z",
"updated_at": "2022-09-04T14:35:46.478566Z",
"structure_string": "Li3 Mn2 Fe1 B3 O9\n1.0\n0.000000 8.173918 -0.004450\n3.093304 0.000000 0.000000\n0.000000 -4.073335 -7.089547\nLi Mn Fe B O\n3 2 1 3 9\ndirect\n0.984887 0.499999 0.700305 Li\n0.300348 0.499999 0.285357 Li\n0.712761 0.499999 0.012547 Li\n0.360530 0.000000 0.990506 Mn\n0.009314 0.000000 0.369555 Mn\n0.632830 0.000000 0.640193 Fe\n0.667455 0.499999 0.336415 B\n0.334903 0.499999 0.665053 B\n0.997741 0.000000 -0.000973 B\n0.530134 0.499999 0.745400 O\n0.916743 0.000000 0.803723 O\n0.576549 0.499999 0.441713 O\n0.193037 0.000000 0.112711 O\n0.862253 0.499999 0.426351 O\n0.562835 0.499999 0.141233 O\n0.253524 0.499999 0.779358 O\n0.883486 0.000000 0.080126 O\n0.220683 0.499999 0.470435 O\n",
"nsites": 18,
"nelements": 5,
"elements": [
"Li",
"Mn",
"Fe",
"B",
"O"
],
"chemical_system": "B-Fe-Li-Mn-O",
"density": 3.3613571606433026,
"density_atomic": 0.10038418905739437,
"volume": 179.3111063507078,
"volume_molar": 5.999092901529402,
"formula_full": "Li3 Mn2 Fe1 B3 O9",
"formula_reduced": "Li3Mn2Fe(BO3)3",
"formula_anonymous": "AB2C3D3E9",
"energy_above_hull": 3.3121649573754786,
"spacegroup": 6
},
{
"id": "jvasp-42335",
"created_at": "2022-09-04T14:36:13.031293Z",
"updated_at": "2022-09-04T14:36:13.031319Z",
"structure_string": "Li4 Mn2 Fe2 B4 O12\n1.0\n5.162624 0.015872 0.105455\n2.549811 4.512348 -0.040086\n2.349455 1.413302 10.313140\nLi Mn Fe B O\n4 2 2 4 12\ndirect\n0.346944 0.579669 0.848982 Li\n0.078791 0.984784 0.664620 Li\n0.921208 0.015215 0.335380 Li\n0.653054 0.420330 0.151018 Li\n0.759885 0.655070 0.617961 Mn\n0.240114 0.344929 0.382039 Mn\n0.661786 0.914072 0.896542 Fe\n0.338212 0.085927 0.103458 Fe\n0.574018 0.686539 0.365868 B\n0.998757 0.750576 0.122608 B\n0.001242 0.249423 0.877392 B\n0.425980 0.313460 0.634132 B\n0.750776 0.744295 0.094538 O\n0.740508 0.516011 0.861648 O\n0.249222 0.255705 0.905462 O\n0.024945 0.983054 0.858627 O\n0.685596 0.051869 0.657633 O\n0.391127 0.584991 0.652492 O\n0.193753 0.299346 0.594326 O\n0.806245 0.700654 0.405674 O\n0.608872 0.415008 0.347508 O\n0.314402 0.948130 0.342367 O\n0.975053 0.016945 0.141373 O\n0.259491 0.483989 0.138352 O\n",
"nsites": 24,
"nelements": 5,
"elements": [
"Li",
"Mn",
"Fe",
"B",
"O"
],
"chemical_system": "B-Fe-Li-Mn-O",
"density": 3.3612756650560662,
"density_atomic": 0.10025650012591891,
"volume": 239.38597467353017,
"volume_molar": 6.0067334810574735,
"formula_full": "Li4 Mn2 Fe2 B4 O12",
"formula_reduced": "Li2MnFe(BO3)2",
"formula_anonymous": "ABC2D2E6",
"energy_above_hull": 3.126807409003831,
"spacegroup": 2
},
{
"id": "jvasp-43821",
"created_at": "2022-09-04T14:35:59.869048Z",
"updated_at": "2022-09-04T14:35:59.869069Z",
"structure_string": "Li2 Cr2 P4 O14\n1.0\n3.210634 4.099120 -0.012891\n-3.210634 4.099120 0.012891\n-1.918991 0.000000 8.749491\nLi Cr P O\n2 2 4 14\ndirect\n0.697326 0.698010 0.000176 Li\n0.301990 0.302674 0.500176 Li\n0.675987 0.675885 0.499998 Cr\n0.324115 0.324013 -0.000002 Cr\n0.216101 0.772720 0.702926 P\n0.227280 0.783900 0.202926 P\n0.783867 0.227059 0.797036 P\n0.772941 0.216133 0.297036 P\n0.617396 0.379366 0.141526 O\n0.948074 0.378252 0.888895 O\n0.607363 0.096659 0.890933 O\n0.620634 0.382604 0.641526 O\n0.000397 0.000530 0.249853 O\n0.999470 0.999603 0.749853 O\n0.379324 0.617566 0.858527 O\n0.379012 0.947585 0.111088 O\n0.096455 0.607668 0.109040 O\n0.903341 0.392637 0.390933 O\n0.052415 0.620988 0.611088 O\n0.392332 0.903545 0.609040 O\n0.382434 0.620676 0.358527 O\n0.621749 0.051926 0.388895 O\n",
"nsites": 22,
"nelements": 4,
"elements": [
"Li",
"Cr",
"P",
"O"
],
"chemical_system": "Cr-Li-O-P",
"density": 3.361247356718702,
"density_atomic": 0.0956117083940316,
"volume": 230.09734236035587,
"volume_molar": 6.298539019072608,
"formula_full": "Li2 Cr2 P4 O14",
"formula_reduced": "LiCrP2O7",
"formula_anonymous": "ABC2D7",
"energy_above_hull": 2.906871172727273,
"spacegroup": 15
},
{
"id": "jvasp-90763",
"created_at": "2022-09-04T14:36:03.831384Z",
"updated_at": "2022-09-04T14:36:03.831420Z",
"structure_string": "La2 Mg6\n1.0\n5.290585 0.000000 -0.000000\n0.000000 5.290585 0.000000\n-0.000000 0.000000 7.477815\nLa Mg\n2 6\ndirect\n0.000000 0.000000 0.000000 La\n0.500000 0.500000 0.500000 La\n0.500000 0.500000 0.000000 Mg\n0.500000 0.000000 0.250000 Mg\n0.000000 0.500000 0.250000 Mg\n0.000000 0.000000 0.500000 Mg\n0.000000 0.500000 0.750000 Mg\n0.500000 0.000000 0.750000 Mg\n",
"nsites": 8,
"nelements": 2,
"elements": [
"La",
"Mg"
],
"chemical_system": "La-Mg",
"density": 3.360972131088072,
"density_atomic": 0.03822151328593339,
"volume": 209.30620774097474,
"volume_molar": 15.755893061974394,
"formula_full": "La2 Mg6",
"formula_reduced": "LaMg3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.307574642857143,
"spacegroup": 225
},
{
"id": "jvasp-112961",
"created_at": "2022-09-04T14:38:43.961717Z",
"updated_at": "2022-09-04T14:38:43.961751Z",
"structure_string": "Li4 In4 Ge2 S12\n1.0\n6.774878 0.024678 2.131197\n3.026327 6.061430 2.131197\n0.020382 0.012656 12.268151\nLi In Ge S\n4 4 2 12\ndirect\n0.585516 0.999690 0.163125 Li\n0.999689 0.585516 0.663125 Li\n0.603890 0.396983 0.501805 Li\n0.396983 0.603891 0.001805 Li\n0.879642 0.076456 0.813052 In\n0.076456 0.879642 0.313052 In\n0.231666 0.082203 0.507060 In\n0.082203 0.231667 0.007060 In\n0.461772 0.990998 0.750663 Ge\n0.990997 0.461773 0.250663 Ge\n0.786095 0.762936 0.330386 S\n0.762935 0.786095 0.830386 S\n0.319747 0.276895 0.302523 S\n0.276895 0.319747 0.802523 S\n0.787840 0.281916 0.306736 S\n0.733999 0.232926 0.995489 S\n0.877640 0.335230 0.620646 S\n0.335230 0.877640 0.120646 S\n0.232925 0.733999 0.495489 S\n0.568595 0.039773 0.558954 S\n0.281916 0.787841 0.806736 S\n0.039772 0.568595 0.058954 S\n",
"nsites": 22,
"nelements": 4,
"elements": [
"Li",
"In",
"Ge",
"S"
],
"chemical_system": "Ge-In-Li-S",
"density": 3.3609325658207703,
"density_atomic": 0.04377956437456971,
"volume": 502.51756302945694,
"volume_molar": 13.755597722434372,
"formula_full": "Li4 In4 Ge2 S12",
"formula_reduced": "Li2In2GeS6",
"formula_anonymous": "AB2C2D6",
"energy_above_hull": 1.3055232627272728,
"spacegroup": 9
},
{
"id": "jvasp-15066",
"created_at": "2022-09-04T14:36:45.179624Z",
"updated_at": "2022-09-04T14:36:45.179651Z",
"structure_string": "Sc1 P1\n1.0\n3.254276 0.000000 1.878857\n1.084758 3.068161 1.878857\n-0.000000 -0.000000 3.757714\nSc P\n1 1\ndirect\n0.000000 0.000000 0.000000 Sc\n0.500001 0.500000 0.500000 P\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Sc",
"P"
],
"chemical_system": "P-Sc",
"density": 3.3605037266175715,
"density_atomic": 0.0533057114750399,
"volume": 37.519431682972446,
"volume_molar": 11.297364941503188,
"formula_full": "Sc1 P1",
"formula_reduced": "ScP",
"formula_anonymous": "AB",
"energy_above_hull": 1.0557553750000004,
"spacegroup": 225
},
{
"id": "jvasp-8588",
"created_at": "2022-09-04T14:37:03.043443Z",
"updated_at": "2022-09-04T14:37:03.043470Z",
"structure_string": "Rb1 Cl1\n1.0\n3.909626 -0.000000 0.000000\n-0.000000 3.909626 0.000000\n0.000000 -0.000000 3.909626\nRb Cl\n1 1\ndirect\n0.000000 0.000000 0.000000 Rb\n0.500001 0.500001 0.500001 Cl\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Rb",
"Cl"
],
"chemical_system": "Cl-Rb",
"density": 3.3600401478091224,
"density_atomic": 0.033467583304692655,
"volume": 59.75931939249316,
"volume_molar": 17.993951655169575,
"formula_full": "Rb1 Cl1",
"formula_reduced": "RbCl",
"formula_anonymous": "AB",
"energy_above_hull": 0.011935,
"spacegroup": 221
},
{
"id": "jvasp-57661",
"created_at": "2022-09-04T14:37:55.095002Z",
"updated_at": "2022-09-04T14:37:55.095032Z",
"structure_string": "Mg4 F8\n1.0\n4.975400 0.000000 0.000000\n-0.000000 4.975400 0.000000\n-0.000000 -0.000000 4.975400\nMg F\n4 8\ndirect\n0.000000 0.500000 0.500000 Mg\n0.500000 0.500000 0.000000 Mg\n0.500000 0.000000 0.500000 Mg\n0.000000 0.000000 0.000000 Mg\n0.341024 0.158976 0.841024 F\n0.158976 0.841024 0.341024 F\n0.841024 0.341024 0.158976 F\n0.658976 0.658976 0.658976 F\n0.341024 0.341024 0.341024 F\n0.158976 0.658976 0.841024 F\n0.841024 0.158976 0.658976 F\n0.658976 0.841024 0.158976 F\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Mg",
"F"
],
"chemical_system": "F-Mg",
"density": 3.3598951296682498,
"density_atomic": 0.09743101806768645,
"volume": 123.16406251306398,
"volume_molar": 6.180927675225922,
"formula_full": "Mg4 F8",
"formula_reduced": "MgF2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.0182366666666666,
"spacegroup": 205
},
{
"id": "jvasp-120107",
"created_at": "2022-09-04T14:38:52.062164Z",
"updated_at": "2022-09-04T14:38:52.062188Z",
"structure_string": "Zn1 Cl2 O1\n1.0\n-1.779072 1.920986 5.506978\n1.779072 -1.920986 5.506978\n1.779072 1.920986 -5.506978\nZn Cl O\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Zn\n0.157038 0.657038 0.500000 Cl\n0.842962 0.342962 0.500000 Cl\n0.500000 0.000000 0.500000 O\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Zn",
"Cl",
"O"
],
"chemical_system": "Cl-O-Zn",
"density": 3.3596884344166176,
"density_atomic": 0.0531335623389327,
"volume": 75.28198419079214,
"volume_molar": 11.333967637226124,
"formula_full": "Zn1 Cl2 O1",
"formula_reduced": "ZnCl2O",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.1819480087499999,
"spacegroup": 71
},
{
"id": "jvasp-26746",
"created_at": "2022-09-04T14:38:19.705021Z",
"updated_at": "2022-09-04T14:38:19.705041Z",
"structure_string": "P4 Pt1 F12\n1.0\n6.651710 0.000000 -2.351735\n-3.325856 5.760551 -2.351735\n-0.000000 -0.000000 7.055205\nP Pt F\n4 1 12\ndirect\n0.000000 0.000000 0.680713 P\n-0.000000 0.680713 0.000000 P\n0.680713 -0.000000 0.000000 P\n0.319287 0.319287 0.319287 P\n0.000000 0.000000 0.000000 Pt\n0.498425 0.291262 0.498425 F\n0.792837 0.501575 0.000001 F\n0.501575 0.792838 0.000001 F\n-0.000000 0.501575 0.792837 F\n0.207162 0.207162 0.708738 F\n0.291261 0.498425 0.498425 F\n0.792838 -0.000000 0.501575 F\n0.207162 0.708738 0.207163 F\n-0.000000 0.792838 0.501575 F\n0.498424 0.498425 0.291262 F\n0.708738 0.207162 0.207163 F\n0.501575 -0.000000 0.792838 F\n",
"nsites": 17,
"nelements": 3,
"elements": [
"P",
"Pt",
"F"
],
"chemical_system": "F-P-Pt",
"density": 3.359677602944787,
"density_atomic": 0.0628842595288468,
"volume": 270.3379212440534,
"volume_molar": 9.576547144102847,
"formula_full": "P4 Pt1 F12",
"formula_reduced": "P4PtF12",
"formula_anonymous": "AB4C12",
"energy_above_hull": 0.8044198111764705,
"spacegroup": 217
},
{
"id": "jvasp-34648",
"created_at": "2022-09-04T14:36:51.641497Z",
"updated_at": "2022-09-04T14:36:51.641517Z",
"structure_string": "Rb4 C4 O8\n1.0\n3.575016 0.000000 0.000000\n0.000000 6.324077 -0.000000\n0.000000 0.000000 11.322484\nRb C O\n4 4 8\ndirect\n0.500001 0.093528 0.151821 Rb\n0.500001 0.406472 0.651820 Rb\n0.500001 0.906473 0.848179 Rb\n0.500001 0.593528 0.348179 Rb\n0.000000 0.067587 0.440955 C\n0.000000 0.567588 0.059045 C\n0.000000 0.932413 0.559045 C\n0.000000 0.432413 0.940955 C\n0.000000 0.465708 0.155581 O\n0.000000 0.266852 0.451657 O\n0.000000 0.233148 0.951657 O\n0.000000 0.965709 0.344419 O\n0.000000 0.034292 0.655581 O\n0.000000 0.534292 0.844419 O\n0.000000 0.733148 0.548342 O\n0.000000 0.766852 0.048342 O\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Rb",
"C",
"O"
],
"chemical_system": "C-O-Rb",
"density": 3.3595868186833875,
"density_atomic": 0.06250332598700675,
"volume": 255.98637748215344,
"volume_molar": 9.63491248650014,
"formula_full": "Rb4 C4 O8",
"formula_reduced": "RbCO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.05979425,
"spacegroup": 55
},
{
"id": "jvasp-48579",
"created_at": "2022-09-04T14:35:51.632226Z",
"updated_at": "2022-09-04T14:35:51.632250Z",
"structure_string": "V4 O4 F12\n1.0\n5.558521 0.000000 0.000000\n0.000000 4.840958 0.000000\n0.000000 0.000000 9.106096\nV O F\n4 4 12\ndirect\n0.179558 0.104241 0.109324 V\n0.320442 0.895759 0.609325 V\n0.679558 0.395759 0.890676 V\n0.820441 0.604241 0.390676 V\n0.137804 0.738826 0.496116 O\n0.362196 0.261175 -0.003884 O\n0.637804 0.761175 0.503884 O\n0.862196 0.238826 0.003884 O\n0.610512 0.699623 -0.012250 F\n0.889487 0.300377 0.487750 F\n0.619270 0.453843 0.267639 F\n0.594908 0.116357 0.766356 F\n0.405092 0.616358 0.733645 F\n0.119270 0.046157 0.732361 F\n0.110513 0.800377 0.012250 F\n0.389487 0.199623 0.512250 F\n0.880730 0.546157 0.767639 F\n0.094908 0.383643 0.233645 F\n0.380730 -0.046157 0.232361 F\n0.905091 0.883643 0.266355 F\n",
"nsites": 20,
"nelements": 3,
"elements": [
"V",
"O",
"F"
],
"chemical_system": "F-O-V",
"density": 3.359573586971324,
"density_atomic": 0.08162199502069534,
"volume": 245.03199162099602,
"volume_molar": 7.378085721223893,
"formula_full": "V4 O4 F12",
"formula_reduced": "VOF3",
"formula_anonymous": "ABC3",
"energy_above_hull": 0.8018777094999998,
"spacegroup": 19
}
]
}