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=4094",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-nelements&page=4092",
"results": [
{
"id": "jvasp-57816",
"created_at": "2022-09-04T14:38:31.246015Z",
"updated_at": "2022-09-04T14:38:31.246046Z",
"structure_string": "Si8 O16\n1.0\n3.879735 0.000000 0.000000\n0.000000 8.699506 0.000000\n0.000000 0.000000 9.865029\nSi O\n8 16\ndirect\n0.343093 0.325127 0.608076 Si\n0.656906 0.674873 0.608076 Si\n0.343093 0.825127 0.891924 Si\n0.656906 0.174873 0.891924 Si\n0.343093 0.174873 0.108076 Si\n0.656906 0.825127 0.108076 Si\n0.343093 0.674873 0.391924 Si\n0.656906 0.325127 0.391924 Si\n0.499999 0.250000 0.750000 O\n0.499999 0.250000 0.250000 O\n0.499999 0.500000 0.633902 O\n0.499999 0.750000 0.750000 O\n0.000000 0.644680 0.500000 O\n0.499999 0.699420 0.000000 O\n0.499999 0.000000 0.866098 O\n0.499999 0.500000 0.366098 O\n0.499999 0.000000 0.133902 O\n0.000000 0.144680 0.000000 O\n0.000000 0.855321 0.000000 O\n0.499999 0.300580 0.000000 O\n0.499999 0.750000 0.250000 O\n0.000000 0.355320 0.500000 O\n0.499999 0.199420 0.500000 O\n0.499999 0.800581 0.500000 O\n",
"nsites": 24,
"nelements": 2,
"elements": [
"Si",
"O"
],
"chemical_system": "O-Si",
"density": 2.3972044176842497,
"density_atomic": 0.07208023945744861,
"volume": 332.96226789268655,
"volume_molar": 8.35477352091078,
"formula_full": "Si8 O16",
"formula_reduced": "SiO2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.6495352000000003,
"spacegroup": 50
},
{
"id": "jvasp-20325",
"created_at": "2022-09-04T14:38:33.306323Z",
"updated_at": "2022-09-04T14:38:33.306364Z",
"structure_string": "Er16 O24\n1.0\n8.580980 0.000000 -3.033835\n-4.290491 7.431347 -3.033835\n-0.000000 -0.000000 9.101505\nEr O\n16 24\ndirect\n0.000000 0.000000 0.000000 Er\n0.250000 0.032703 0.782703 Er\n0.717297 0.750000 0.467298 Er\n0.467297 0.717297 0.750000 Er\n0.782703 0.250000 0.032704 Er\n0.032703 0.782703 0.250000 Er\n0.750000 0.967297 0.217298 Er\n0.750000 0.467297 0.717297 Er\n0.532703 0.282703 0.250000 Er\n0.217297 0.750000 0.967297 Er\n0.967297 0.217297 0.750000 Er\n0.250000 0.532703 0.282703 Er\n0.500000 0.500000 0.000001 Er\n0.500000 -0.000000 0.500000 Er\n0.282703 0.250000 0.532703 Er\n0.000000 0.500000 0.500000 Er\n0.956553 0.728908 0.968296 O\n0.543447 0.511742 0.772356 O\n0.260613 0.988258 0.531705 O\n0.727645 0.239388 0.771092 O\n0.011742 0.468296 0.739388 O\n0.968296 0.956553 0.728909 O\n0.228908 0.272355 0.760612 O\n0.271092 0.031704 0.043447 O\n0.227645 0.456553 0.488258 O\n0.456553 0.488258 0.227645 O\n0.739388 0.011742 0.468296 O\n0.272356 0.760613 0.228909 O\n0.043447 0.271092 0.031704 O\n0.239388 0.771092 0.727645 O\n0.468296 0.739388 0.011743 O\n0.031704 0.043447 0.271092 O\n0.488258 0.227645 0.456553 O\n0.988258 0.531704 0.260613 O\n0.771092 0.727645 0.239388 O\n0.728908 0.968296 0.956553 O\n0.772355 0.543447 0.511743 O\n0.511742 0.772356 0.543448 O\n0.760612 0.228908 0.272356 O\n0.531704 0.260612 0.988258 O\n",
"nsites": 40,
"nelements": 2,
"elements": [
"Er",
"O"
],
"chemical_system": "Er-O",
"density": 8.755304897379045,
"density_atomic": 0.06891953661956648,
"volume": 580.386955019716,
"volume_molar": 8.737929845991294,
"formula_full": "Er16 O24",
"formula_reduced": "Er2O3",
"formula_anonymous": "A2B3",
"energy_above_hull": 1.3434860999999998,
"spacegroup": 206
},
{
"id": "jvasp-116301",
"created_at": "2022-09-04T14:38:42.412754Z",
"updated_at": "2022-09-04T14:38:42.412782Z",
"structure_string": "Li2 Se1\n1.0\n4.054516 0.000000 0.000000\n0.000000 4.754957 0.000000\n0.000000 0.000000 5.759319\nLi Se\n2 1\ndirect\n-0.033328 0.000000 0.786283 Li\n-0.033328 0.000000 0.213718 Li\n0.466657 0.000000 0.000000 Se\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Li",
"Se"
],
"chemical_system": "Li-Se",
"density": 1.3884710797806403,
"density_atomic": 0.027018703668117185,
"volume": 111.03419456574753,
"volume_molar": 22.288784961605295,
"formula_full": "Li2 Se1",
"formula_reduced": "Li2Se",
"formula_anonymous": "AB2",
"energy_above_hull": 0.5805511222222223,
"spacegroup": 47
},
{
"id": "jvasp-114175",
"created_at": "2022-09-04T14:38:40.711582Z",
"updated_at": "2022-09-04T14:38:40.711613Z",
"structure_string": "Ca1 O3\n1.0\n5.000513 0.627829 0.562719\n-1.946875 -2.665708 0.268791\n1.163841 1.390417 -4.093829\nCa O\n1 3\ndirect\n0.620517 -0.145786 -0.068574 Ca\n0.698280 0.726354 0.365090 O\n0.070477 0.325071 0.454440 O\n0.121344 0.758052 0.818950 O\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ca",
"O"
],
"chemical_system": "Ca-O",
"density": 3.039576555612896,
"density_atomic": 0.08313146059899297,
"volume": 48.116561060981226,
"volume_molar": 7.244117589909097,
"formula_full": "Ca1 O3",
"formula_reduced": "CaO3",
"formula_anonymous": "AB3",
"energy_above_hull": 1.79658925,
"spacegroup": 1
},
{
"id": "jvasp-38018",
"created_at": "2022-09-04T14:38:33.863207Z",
"updated_at": "2022-09-04T14:38:33.863231Z",
"structure_string": "Al2 Ag4\n1.0\n5.057840 -0.061883 0.000000\n-2.582513 4.349276 0.000000\n0.000000 0.000000 4.628089\nAl Ag\n2 4\ndirect\n0.016561 0.016561 0.000000 Al\n0.650237 0.650237 0.500000 Al\n0.682308 0.360827 0.000000 Ag\n0.360827 0.682309 0.000000 Ag\n0.305945 0.984458 0.500000 Ag\n0.984458 0.305945 0.500000 Ag\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Al",
"Ag"
],
"chemical_system": "Ag-Al",
"density": 7.975608903864504,
"density_atomic": 0.05936550025031349,
"volume": 101.06880216120669,
"volume_molar": 10.144175884322983,
"formula_full": "Al2 Ag4",
"formula_reduced": "AlAg2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.3158091066666668,
"spacegroup": 63
},
{
"id": "jvasp-54612",
"created_at": "2022-09-04T14:38:34.577594Z",
"updated_at": "2022-09-04T14:38:34.577608Z",
"structure_string": "Ti4 Cu6\n1.0\n3.155955 0.000000 -0.000000\n0.000000 3.155955 -0.000000\n-0.000000 0.000000 13.944304\nTi Cu\n4 6\ndirect\n0.500001 0.500001 0.559873 Ti\n0.500001 0.500001 0.146028 Ti\n0.000000 0.000000 0.440129 Ti\n0.000000 0.000000 0.853972 Ti\n0.500001 0.500001 0.954757 Cu\n0.500001 0.500001 0.755121 Cu\n0.500001 0.500001 0.337393 Cu\n0.000000 0.000000 0.244877 Cu\n0.000000 0.000000 0.045243 Cu\n0.000000 0.000000 0.662606 Cu\n",
"nsites": 10,
"nelements": 2,
"elements": [
"Ti",
"Cu"
],
"chemical_system": "Cu-Ti",
"density": 6.847802075848589,
"density_atomic": 0.07200150156375539,
"volume": 138.88599241427306,
"volume_molar": 8.363909959110446,
"formula_full": "Ti4 Cu6",
"formula_reduced": "Ti2Cu3",
"formula_anonymous": "A2B3",
"energy_above_hull": 1.3343016033333337,
"spacegroup": 129
},
{
"id": "jvasp-118400",
"created_at": "2022-09-04T14:38:33.305891Z",
"updated_at": "2022-09-04T14:38:33.305914Z",
"structure_string": "H1 F1\n1.0\n2.344913 -0.000000 -0.000000\n-1.172457 2.030754 0.000000\n-0.000000 0.000000 2.974093\nH F\n1 1\ndirect\n0.000000 0.000000 0.000000 H\n0.333331 0.666665 0.000000 F\n",
"nsites": 2,
"nelements": 2,
"elements": [
"H",
"F"
],
"chemical_system": "F-H",
"density": 2.3457310450685016,
"density_atomic": 0.14121843659451147,
"volume": 14.162456745946805,
"volume_molar": 4.264415401575161,
"formula_full": "H1 F1",
"formula_reduced": "HF",
"formula_anonymous": "AB",
"energy_above_hull": 0.22927014125,
"spacegroup": 187
},
{
"id": "jvasp-54921",
"created_at": "2022-09-04T14:38:33.865846Z",
"updated_at": "2022-09-04T14:38:33.865866Z",
"structure_string": "Ge6 N8\n1.0\n5.616710 0.000000 -1.985808\n-2.808355 4.864214 -1.985808\n-0.000000 -0.000000 5.957422\nGe N\n6 8\ndirect\n0.124999 0.874999 0.249999 Ge\n0.624999 0.749999 0.374999 Ge\n0.875000 0.250000 0.124999 Ge\n0.374999 0.624999 0.749999 Ge\n0.250000 0.125000 0.875000 Ge\n0.749999 0.375000 0.624999 Ge\n0.947632 0.500000 -0.000001 N\n0.500000 0.000000 0.447633 N\n0.552366 0.552366 0.552366 N\n-0.000001 0.947632 0.499999 N\n0.052367 0.052367 0.052367 N\n0.447632 0.500000 -0.000001 N\n-0.000001 0.447633 0.499999 N\n0.500000 0.000000 0.947633 N\n",
"nsites": 14,
"nelements": 2,
"elements": [
"Ge",
"N"
],
"chemical_system": "Ge-N",
"density": 5.589748724570872,
"density_atomic": 0.08601515896816628,
"volume": 162.7620080918681,
"volume_molar": 7.001255165067776,
"formula_full": "Ge6 N8",
"formula_reduced": "Ge3N4",
"formula_anonymous": "A3B4",
"energy_above_hull": 3.74569155,
"spacegroup": 220
},
{
"id": "jvasp-56871",
"created_at": "2022-09-04T14:38:33.299115Z",
"updated_at": "2022-09-04T14:38:33.299155Z",
"structure_string": "Ba3 Cl6\n1.0\n4.055656 -7.024601 0.000000\n4.055656 7.024601 0.000000\n-0.000000 0.000000 4.639775\nBa Cl\n3 6\ndirect\n0.000000 0.000000 0.500001 Ba\n0.666667 0.333334 0.000000 Ba\n0.333334 0.666667 0.000000 Ba\n0.000000 0.743655 0.000000 Cl\n0.588897 0.588897 0.500001 Cl\n0.411104 0.000000 0.500001 Cl\n0.256346 0.256346 0.000000 Cl\n0.000000 0.411104 0.500001 Cl\n0.743655 0.000000 0.000000 Cl\n",
"nsites": 9,
"nelements": 2,
"elements": [
"Ba",
"Cl"
],
"chemical_system": "Ba-Cl",
"density": 3.9238303292371994,
"density_atomic": 0.034043391637045325,
"volume": 264.36848877907875,
"volume_molar": 17.689602799289922,
"formula_full": "Ba3 Cl6",
"formula_reduced": "BaCl2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.0006433333333334,
"spacegroup": 189
},
{
"id": "jvasp-114823",
"created_at": "2022-09-04T14:38:42.163539Z",
"updated_at": "2022-09-04T14:38:42.163566Z",
"structure_string": "Ag2 Se1\n1.0\n4.550916 -0.842238 -0.225802\n1.332663 -4.143173 -0.586177\n-1.028052 -2.094456 -3.992141\nAg Se\n2 1\ndirect\n0.207985 0.510666 0.766647 Ag\n0.704532 0.512436 0.268005 Ag\n-0.043888 0.011570 0.017130 Se\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Ag",
"Se"
],
"chemical_system": "Ag-Se",
"density": 7.382129754432597,
"density_atomic": 0.045256295467274575,
"volume": 66.28911997822136,
"volume_molar": 13.306747045512573,
"formula_full": "Ag2 Se1",
"formula_reduced": "Ag2Se",
"formula_anonymous": "AB2",
"energy_above_hull": 0.2464092955555556,
"spacegroup": 139
},
{
"id": "jvasp-57669",
"created_at": "2022-09-04T14:38:33.274023Z",
"updated_at": "2022-09-04T14:38:33.274056Z",
"structure_string": "Zr4 Cr8\n1.0\n2.540814 -4.400820 0.000000\n2.540814 4.400820 -0.000000\n-0.000000 -0.000000 8.070107\nZr Cr\n4 8\ndirect\n0.333332 0.666666 0.059983 Zr\n0.666666 0.333332 0.559983 Zr\n0.666666 0.333332 0.940017 Zr\n0.333332 0.666666 0.440017 Zr\n0.000000 0.000000 0.000000 Cr\n0.000000 0.000000 0.500000 Cr\n0.335024 0.167512 0.250000 Cr\n0.167512 0.335024 0.750000 Cr\n0.167512 0.832487 0.750000 Cr\n0.832487 0.167512 0.250000 Cr\n0.832486 0.664974 0.250000 Cr\n0.664974 0.832486 0.750000 Cr\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Zr",
"Cr"
],
"chemical_system": "Cr-Zr",
"density": 7.184708879968847,
"density_atomic": 0.06649140011394536,
"volume": 180.47446706545165,
"volume_molar": 9.057022035451116,
"formula_full": "Zr4 Cr8",
"formula_reduced": "ZrCr2",
"formula_anonymous": "AB2",
"energy_above_hull": 4.098713100000001,
"spacegroup": 194
},
{
"id": "jvasp-114457",
"created_at": "2022-09-04T14:38:40.740401Z",
"updated_at": "2022-09-04T14:38:40.740428Z",
"structure_string": "N2 F1\n1.0\n5.291772 0.000000 0.000000\n0.000000 6.350127 0.000000\n0.000000 0.000000 3.175063\nN F\n2 1\ndirect\n0.142410 0.968486 0.000000 N\n0.857590 0.968486 0.000000 N\n0.000000 0.351028 0.000000 F\n",
"nsites": 3,
"nelements": 2,
"elements": [
"N",
"F"
],
"chemical_system": "F-N",
"density": 0.7316782153910637,
"density_atomic": 0.02811806124658475,
"volume": 106.69298902549276,
"volume_molar": 21.417339933888417,
"formula_full": "N2 F1",
"formula_reduced": "N2F",
"formula_anonymous": "AB2",
"energy_above_hull": 3.644448927499999,
"spacegroup": 25
}
]
}