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=updated_at&page=210",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=updated_at&page=208",
"results": [
{
"id": "jvasp-19873",
"created_at": "2022-09-04T14:35:47.584073Z",
"updated_at": "2022-09-04T14:35:47.584103Z",
"structure_string": "Ba2 Sn2\n1.0\n4.705200 0.000000 0.000000\n0.000000 4.908254 -2.087532\n0.000000 0.020312 6.861727\nBa Sn\n2 2\ndirect\n0.250000 0.864317 0.728638 Ba\n0.750000 0.135682 0.271363 Ba\n0.250000 0.574414 0.148830 Sn\n0.750000 0.425584 0.851170 Sn\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ba",
"Sn"
],
"chemical_system": "Ba-Sn",
"density": 5.359161413655409,
"density_atomic": 0.02521012541136362,
"volume": 158.66640624472956,
"volume_molar": 23.88778580722761,
"formula_full": "Ba2 Sn2",
"formula_reduced": "BaSn",
"formula_anonymous": "AB",
"energy_above_hull": 0.0,
"spacegroup": 63
},
{
"id": "jvasp-43590",
"created_at": "2022-09-04T14:35:47.589968Z",
"updated_at": "2022-09-04T14:35:47.589990Z",
"structure_string": "Li2 Fe2 F8\n1.0\n4.982286 0.051219 0.382194\n-0.110941 4.628823 0.076296\n-0.430036 -0.102249 5.598038\nLi Fe F\n2 2 8\ndirect\n0.749991 -0.000008 0.649252 Li\n0.250009 0.000008 0.350748 Li\n0.750026 0.499955 0.172501 Fe\n0.249974 0.500044 0.827500 Fe\n0.586080 0.237613 0.380710 F\n0.076185 0.274440 0.111039 F\n0.086059 0.237601 0.619309 F\n0.576145 0.274436 0.888980 F\n0.423855 0.725563 0.111020 F\n0.913941 0.762398 0.380691 F\n0.923815 0.725559 0.888961 F\n0.413920 0.762387 0.619290 F\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Li",
"Fe",
"F"
],
"chemical_system": "F-Fe-Li",
"density": 3.547094903321752,
"density_atomic": 0.09235263468438265,
"volume": 129.93673695407054,
"volume_molar": 6.520810998604221,
"formula_full": "Li2 Fe2 F8",
"formula_reduced": "LiFeF4",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.2271611049999998,
"spacegroup": 13
},
{
"id": "jvasp-37104",
"created_at": "2022-09-04T14:35:47.592211Z",
"updated_at": "2022-09-04T14:35:47.592237Z",
"structure_string": "Sc2 Mn1 Ge1\n1.0\n3.205248 3.205248 0.000000\n3.205248 0.000000 -3.205248\n-0.000000 3.205248 -3.205248\nSc Mn Ge\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Sc\n0.750000 0.750000 0.750000 Sc\n0.500000 0.500000 0.500000 Mn\n0.250000 0.250000 0.250000 Ge\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sc",
"Mn",
"Ge"
],
"chemical_system": "Ge-Mn-Sc",
"density": 5.4836940946633765,
"density_atomic": 0.06073584555656864,
"volume": 65.85896620595243,
"volume_molar": 9.915299120008216,
"formula_full": "Sc2 Mn1 Ge1",
"formula_reduced": "Sc2MnGe",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.5090284228448274,
"spacegroup": 216
},
{
"id": "jvasp-98982",
"created_at": "2022-09-04T14:35:47.597211Z",
"updated_at": "2022-09-04T14:35:47.597231Z",
"structure_string": "Ba8 Zn4 O12\n1.0\n5.863206 -0.000000 0.361740\n2.931604 5.755350 0.180870\n-0.024339 0.000000 12.717259\nBa Zn O\n8 4 12\ndirect\n0.862681 0.791962 0.424994 Ba\n0.137319 0.208037 0.575006 Ba\n0.654642 0.208037 0.924994 Ba\n0.562351 0.410365 0.347471 Ba\n0.972716 0.589635 0.847471 Ba\n0.437649 0.589635 0.652530 Ba\n0.027284 0.410365 0.152530 Ba\n0.345358 0.791962 0.075006 Ba\n0.726191 0.004125 0.163621 Zn\n0.273809 0.995875 0.836379 Zn\n0.269685 0.004125 0.336379 Zn\n0.730315 0.995875 0.663621 Zn\n0.131881 0.197285 0.965342 O\n0.856408 0.657179 0.633149 O\n0.486413 0.657179 0.866851 O\n0.143592 0.342821 0.366851 O\n0.404546 0.190910 0.750000 O\n0.996289 0.007424 0.250000 O\n0.003711 0.992576 0.750000 O\n0.329164 0.802715 0.465342 O\n0.868119 0.802715 0.034658 O\n0.670836 0.197285 0.534658 O\n0.513587 0.342821 0.133149 O\n0.595454 0.809090 0.250000 O\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Ba",
"Zn",
"O"
],
"chemical_system": "Ba-O-Zn",
"density": 6.0056168928875575,
"density_atomic": 0.05591902044126207,
"volume": 429.1920675758234,
"volume_molar": 10.76939601673767,
"formula_full": "Ba8 Zn4 O12",
"formula_reduced": "Ba2ZnO3",
"formula_anonymous": "AB2C3",
"energy_above_hull": 0.5580471616666668,
"spacegroup": 15
},
{
"id": "jvasp-75806",
"created_at": "2022-09-04T14:35:47.602408Z",
"updated_at": "2022-09-04T14:35:47.602431Z",
"structure_string": "Re1 Sn1 As1\n1.0\n-0.000000 3.153875 3.153875\n3.153875 -0.000000 3.153875\n3.153875 3.153875 0.000000\nRe Sn As\n1 1 1\ndirect\n0.749999 0.749999 0.749999 Re\n0.000000 0.000000 0.000000 Sn\n0.499999 0.499999 0.499999 As\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Re",
"Sn",
"As"
],
"chemical_system": "As-Re-Sn",
"density": 10.052747367358496,
"density_atomic": 0.04781430298964347,
"volume": 62.742732036683606,
"volume_molar": 12.59485213306234,
"formula_full": "Re1 Sn1 As1",
"formula_reduced": "ReSnAs",
"formula_anonymous": "ABC",
"energy_above_hull": 3.05607715,
"spacegroup": 216
},
{
"id": "jvasp-67118",
"created_at": "2022-09-04T14:35:47.608048Z",
"updated_at": "2022-09-04T14:35:47.608086Z",
"structure_string": "Be2 V1 Si1\n1.0\n3.080761 -0.000000 0.000000\n-0.000000 3.080761 -0.000000\n0.000000 -0.000000 4.803771\nBe V Si\n2 1 1\ndirect\n0.000000 0.000000 0.238243 Be\n0.000000 0.000000 0.761757 Be\n0.500000 0.500000 0.000000 V\n0.500000 0.500000 0.500000 Si\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"V",
"Si"
],
"chemical_system": "Be-Si-V",
"density": 3.534698937213296,
"density_atomic": 0.08773273728116594,
"volume": 45.593014921907624,
"volume_molar": 6.864188838312703,
"formula_full": "Be2 V1 Si1",
"formula_reduced": "Be2VSi",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.82820875,
"spacegroup": 123
},
{
"id": "jvasp-90064",
"created_at": "2022-09-04T14:35:47.608604Z",
"updated_at": "2022-09-04T14:35:47.608630Z",
"structure_string": "Eu3 S2 F4\n1.0\n3.865576 0.000000 -0.000000\n0.000000 3.865576 0.000000\n-1.932788 -1.932788 9.908613\nEu S F\n3 2 4\ndirect\n0.000000 0.000000 0.000000 Eu\n0.664173 0.664173 0.328346 Eu\n0.335827 0.335827 0.671654 Eu\n0.805697 0.805697 0.611394 S\n0.194303 0.194303 0.388606 S\n0.067531 0.567532 0.135062 F\n0.567532 0.067531 0.135062 F\n0.932469 0.432469 0.864937 F\n0.432469 0.932469 0.864937 F\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Eu",
"S",
"F"
],
"chemical_system": "Eu-F-S",
"density": 6.68444624034405,
"density_atomic": 0.06078567034196363,
"volume": 148.06121162057522,
"volume_molar": 9.90717174972502,
"formula_full": "Eu3 S2 F4",
"formula_reduced": "Eu3(SF2)2",
"formula_anonymous": "A2B3C4",
"energy_above_hull": 0.6415779033333333,
"spacegroup": 139
},
{
"id": "jvasp-74562",
"created_at": "2022-09-04T14:35:47.609114Z",
"updated_at": "2022-09-04T14:35:47.609144Z",
"structure_string": "Be1 V1 Rh1\n1.0\n1.344765 -2.329200 0.000000\n1.344765 2.329200 -0.000000\n0.000000 -0.000000 5.918900\nBe V Rh\n1 1 1\ndirect\n0.000000 0.000000 0.990774 Be\n0.333335 0.666669 0.326304 V\n0.666669 0.333335 0.682923 Rh\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Be",
"V",
"Rh"
],
"chemical_system": "Be-Rh-V",
"density": 7.293519855644224,
"density_atomic": 0.08090904549991497,
"volume": 37.0786724953164,
"volume_molar": 7.443099498691193,
"formula_full": "Be1 V1 Rh1",
"formula_reduced": "BeVRh",
"formula_anonymous": "ABC",
"energy_above_hull": 2.6582677666666665,
"spacegroup": 156
},
{
"id": "jvasp-74942",
"created_at": "2022-09-04T14:35:47.609949Z",
"updated_at": "2022-09-04T14:35:47.609982Z",
"structure_string": "Be2 Cr1 Cu1\n1.0\n2.497996 0.000000 -0.000000\n0.000000 2.497996 0.000000\n0.000000 0.000000 6.250915\nBe Cr Cu\n2 1 1\ndirect\n0.000000 0.000000 0.019954 Be\n0.500001 0.500001 0.219460 Be\n0.000000 0.000000 0.475146 Cr\n0.500001 0.500001 0.785439 Cu\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Cr",
"Cu"
],
"chemical_system": "Be-Cr-Cu",
"density": 5.68616497083536,
"density_atomic": 0.10254935206126425,
"volume": 39.00560968547466,
"volume_molar": 5.872431798888694,
"formula_full": "Be2 Cr1 Cu1",
"formula_reduced": "Be2CrCu",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.0243600125,
"spacegroup": 99
},
{
"id": "jvasp-49959",
"created_at": "2022-09-04T14:35:47.610523Z",
"updated_at": "2022-09-04T14:35:47.610546Z",
"structure_string": "Tb1 Si2 Rh3\n1.0\n2.766056 -4.790949 0.000000\n2.766056 4.790949 0.000000\n0.000000 -0.000000 3.677280\nTb Si Rh\n1 2 3\ndirect\n0.000000 0.000000 0.000000 Tb\n0.666668 0.333334 0.000000 Si\n0.333334 0.666668 0.000000 Si\n0.500001 0.500001 0.500000 Rh\n0.000000 0.500000 0.500000 Rh\n0.500000 0.000000 0.500000 Rh\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Tb",
"Si",
"Rh"
],
"chemical_system": "Rh-Si-Tb",
"density": 8.92454398127499,
"density_atomic": 0.06156190336982593,
"volume": 97.46287349102418,
"volume_molar": 9.782252383950336,
"formula_full": "Tb1 Si2 Rh3",
"formula_reduced": "TbSi2Rh3",
"formula_anonymous": "AB2C3",
"energy_above_hull": 2.8686391,
"spacegroup": 191
},
{
"id": "jvasp-65222",
"created_at": "2022-09-04T14:35:47.613852Z",
"updated_at": "2022-09-04T14:35:47.613869Z",
"structure_string": "Be1 Te1 Ir4\n1.0\n0.000000 3.711872 3.711872\n3.711872 0.000000 3.711872\n3.711872 3.711872 0.000000\nBe Te Ir\n1 1 4\ndirect\n0.000000 0.000000 0.000000 Be\n0.250000 0.250000 0.250000 Te\n0.123533 0.625489 0.625489 Ir\n0.625489 0.625489 0.625489 Ir\n0.625489 0.123533 0.625489 Ir\n0.625489 0.625489 0.123533 Ir\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Be",
"Te",
"Ir"
],
"chemical_system": "Be-Ir-Te",
"density": 14.700058952176644,
"density_atomic": 0.05866002988074133,
"volume": 102.28429839190825,
"volume_molar": 10.266174040898552,
"formula_full": "Be1 Te1 Ir4",
"formula_reduced": "BeTeIr4",
"formula_anonymous": "ABC4",
"energy_above_hull": 4.045121377777777,
"spacegroup": 216
},
{
"id": "jvasp-60888",
"created_at": "2022-09-04T14:35:47.615692Z",
"updated_at": "2022-09-04T14:35:47.615729Z",
"structure_string": "Ho8 Au4\n1.0\n4.891879 -0.000000 0.000000\n-0.000000 7.006100 0.000000\n0.000000 0.000000 8.869576\nHo Au\n8 4\ndirect\n0.250000 0.848302 0.080992 Ho\n0.750000 0.651698 0.580992 Ho\n0.750000 0.151698 0.919008 Ho\n0.250000 0.348302 0.419008 Ho\n0.250000 0.488434 0.822540 Ho\n0.750000 0.011566 0.322539 Ho\n0.750000 0.511566 0.177461 Ho\n0.250000 0.988434 0.677461 Ho\n0.250000 0.258604 0.098230 Au\n0.750000 0.241396 0.598230 Au\n0.750000 0.741396 0.901770 Au\n0.250000 0.758604 0.401770 Au\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Ho",
"Au"
],
"chemical_system": "Au-Ho",
"density": 11.511247406965678,
"density_atomic": 0.03947538265732701,
"volume": 303.98692025782515,
"volume_molar": 15.255433524929321,
"formula_full": "Ho8 Au4",
"formula_reduced": "Ho2Au",
"formula_anonymous": "AB2",
"energy_above_hull": 0.7262395677777781,
"spacegroup": 62
}
]
}