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=-created_at&page=3675",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-created_at&page=3673",
"results": [
{
"id": "jvasp-67236",
"created_at": "2022-09-04T14:36:12.927620Z",
"updated_at": "2022-09-04T14:36:12.927645Z",
"structure_string": "Be2 Cu1 W1\n1.0\n2.670543 0.000000 -0.000000\n0.000000 2.670543 -0.000000\n0.000000 0.000000 6.166255\nBe Cu W\n2 1 1\ndirect\n0.000000 0.000000 0.049051 Be\n0.500000 0.500000 0.234736 Be\n0.000000 0.000000 0.445613 Cu\n0.500000 0.500000 0.770597 W\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Cu",
"W"
],
"chemical_system": "Be-Cu-W",
"density": 10.021814135529846,
"density_atomic": 0.09095767701908593,
"volume": 43.976496883937216,
"volume_molar": 6.620816359169282,
"formula_full": "Be2 Cu1 W1",
"formula_reduced": "Be2CuW",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.7975981625,
"spacegroup": 99
},
{
"id": "jvasp-52817",
"created_at": "2022-09-04T14:36:12.927248Z",
"updated_at": "2022-09-04T14:36:12.927271Z",
"structure_string": "Li1 Al3 Si9 N14 O2\n1.0\n5.709014 -0.000850 -0.003979\n0.016098 7.880025 0.002539\n0.026794 3.904131 6.858375\nLi Al Si N O\n1 3 9 14 2\ndirect\n0.285365 0.333040 0.338636 Li\n0.542050 0.754798 0.166264 Al\n0.842942 0.424011 0.496611 Al\n0.340417 0.575750 0.909247 Al\n0.050688 0.250552 0.921974 Si\n0.331845 0.512185 0.570929 Si\n0.039848 0.915922 0.832491 Si\n0.342055 0.910514 0.514322 Si\n0.540092 0.093526 0.741285 Si\n0.840324 0.083186 0.428631 Si\n0.543086 0.171070 0.082174 Si\n0.851809 0.482505 0.080528 Si\n0.051051 0.832354 0.252880 Si\n0.799132 0.013356 0.676569 N\n0.291845 0.309285 0.019327 N\n0.053332 0.663227 0.954237 N\n0.073010 0.387276 0.672106 N\n0.414995 0.669299 0.653022 N\n0.297785 0.991462 0.685361 N\n0.280218 0.668711 0.320515 N\n0.795690 0.316745 0.000614 N\n0.563741 0.053185 0.342951 N\n0.540924 0.344659 0.587930 N\n0.544149 0.014452 0.987829 N\n0.918543 0.331579 0.324862 N\n0.041931 0.997289 0.003829 N\n0.065429 0.947957 0.393975 N\n0.580750 0.595211 0.059563 O\n0.805741 0.690238 0.314663 O\n",
"nsites": 29,
"nelements": 5,
"elements": [
"Li",
"Al",
"Si",
"N",
"O"
],
"chemical_system": "Al-Li-N-O-Si",
"density": 3.061523048029216,
"density_atomic": 0.09400842318179208,
"volume": 308.48299565582795,
"volume_molar": 6.405958696227119,
"formula_full": "Li1 Al3 Si9 N14 O2",
"formula_reduced": "LiAl3Si9(N7O)2",
"formula_anonymous": "AB2C3D9E14",
"energy_above_hull": 4.866287527586207,
"spacegroup": 1
},
{
"id": "jvasp-90964",
"created_at": "2022-09-04T14:36:12.925302Z",
"updated_at": "2022-09-04T14:36:12.925327Z",
"structure_string": "Nb1 Sn1 Ru2\n1.0\n-9.114890 0.000000 -5.262484\n-5.843896 -1.163311 -0.403044\n-4.437871 2.813526 -2.838350\nNb Sn Ru\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Nb\n0.499999 0.000001 0.000000 Sn\n0.769714 0.000001 0.000000 Ru\n0.230285 0.000000 0.000000 Ru\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Nb",
"Sn",
"Ru"
],
"chemical_system": "Nb-Ru-Sn",
"density": 9.378182983106036,
"density_atomic": 0.054599025655453014,
"volume": 73.26138061953684,
"volume_molar": 11.029758659069671,
"formula_full": "Nb1 Sn1 Ru2",
"formula_reduced": "NbSnRu2",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.862530525,
"spacegroup": 71
},
{
"id": "jvasp-1807",
"created_at": "2022-09-04T14:36:12.923827Z",
"updated_at": "2022-09-04T14:36:12.923837Z",
"structure_string": "K1 Sm1 S2\n1.0\n3.973692 0.003512 6.567054\n1.834857 3.524704 6.567054\n0.005781 0.003512 7.675701\nK Sm S\n1 1 2\ndirect\n0.500000 0.499999 0.500000 K\n0.000000 0.000000 0.000000 Sm\n0.736189 0.736187 0.736189 S\n0.263811 0.263810 0.263811 S\n",
"nsites": 4,
"nelements": 3,
"elements": [
"K",
"Sm",
"S"
],
"chemical_system": "K-S-Sm",
"density": 3.925396542405993,
"density_atomic": 0.03728766749152928,
"volume": 107.27407395243183,
"volume_molar": 16.15048933100485,
"formula_full": "K1 Sm1 S2",
"formula_reduced": "KSmS2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.58831421875,
"spacegroup": 166
},
{
"id": "jvasp-75461",
"created_at": "2022-09-04T14:36:12.909216Z",
"updated_at": "2022-09-04T14:36:12.909244Z",
"structure_string": "In1 Ni2 As1\n1.0\n-0.000000 3.153554 3.153554\n3.153554 -0.000000 3.153554\n3.153554 3.153554 0.000000\nIn Ni As\n1 2 1\ndirect\n0.749999 0.749999 0.749999 In\n0.000000 0.000000 0.000000 Ni\n0.250000 0.250000 0.250000 Ni\n0.499999 0.499999 0.499999 As\n",
"nsites": 4,
"nelements": 3,
"elements": [
"In",
"Ni",
"As"
],
"chemical_system": "As-In-Ni",
"density": 8.13084037052943,
"density_atomic": 0.06377187402364637,
"volume": 62.723576204092964,
"volume_molar": 9.443255121790857,
"formula_full": "In1 Ni2 As1",
"formula_reduced": "InNi2As",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.05442913,
"spacegroup": 216
},
{
"id": "jvasp-65704",
"created_at": "2022-09-04T14:36:12.904799Z",
"updated_at": "2022-09-04T14:36:12.904824Z",
"structure_string": "Ba1 Cd2 Cl1\n1.0\n4.227962 0.000000 0.000000\n0.000000 4.227962 0.000000\n-0.000000 0.000000 7.177342\nBa Cd Cl\n1 2 1\ndirect\n0.500000 0.500000 0.689265 Ba\n0.000000 0.000000 0.063950 Cd\n0.500000 0.500000 0.179043 Cd\n0.000000 0.000000 0.567742 Cl\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"Cd",
"Cl"
],
"chemical_system": "Ba-Cd-Cl",
"density": 5.146024698754785,
"density_atomic": 0.03117699116307003,
"volume": 128.2997444839419,
"volume_molar": 19.315978018858296,
"formula_full": "Ba1 Cd2 Cl1",
"formula_reduced": "BaCd2Cl",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.2499999999998623e-05,
"spacegroup": 99
},
{
"id": "jvasp-106177",
"created_at": "2022-09-04T14:36:12.903078Z",
"updated_at": "2022-09-04T14:36:12.903106Z",
"structure_string": "Mg1 Cr1 F6\n1.0\n4.452807 0.064665 2.876061\n1.598949 4.156325 2.876062\n0.092713 0.064665 5.300059\nMg Cr F\n1 1 6\ndirect\n0.500000 0.500001 0.500000 Mg\n0.000000 0.000000 0.000000 Cr\n0.237756 0.639073 0.883298 F\n0.639073 0.883298 0.237755 F\n0.116702 0.762244 0.360927 F\n0.360927 0.116703 0.762244 F\n0.762244 0.360928 0.116701 F\n0.883298 0.237757 0.639072 F\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Mg",
"Cr",
"F"
],
"chemical_system": "Cr-F-Mg",
"density": 3.2942695716021984,
"density_atomic": 0.08340279231289723,
"volume": 95.92004989457526,
"volume_molar": 7.220550527141942,
"formula_full": "Mg1 Cr1 F6",
"formula_reduced": "MgCrF6",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.066752268125,
"spacegroup": 148
},
{
"id": "jvasp-70289",
"created_at": "2022-09-04T14:36:12.902618Z",
"updated_at": "2022-09-04T14:36:12.902656Z",
"structure_string": "Be1 Ir4 Pt1\n1.0\n-0.000000 3.629706 3.629706\n3.629706 0.000000 3.629706\n3.629706 3.629706 -0.000000\nBe Ir Pt\n1 4 1\ndirect\n0.000000 0.000000 0.000000 Be\n0.374861 0.374861 0.374861 Ir\n0.374861 0.875419 0.374861 Ir\n0.374861 0.374861 0.875419 Ir\n0.875419 0.374861 0.374861 Ir\n0.750001 0.750001 0.750001 Pt\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Be",
"Ir",
"Pt"
],
"chemical_system": "Be-Ir-Pt",
"density": 16.892798685125904,
"density_atomic": 0.0627345672714561,
"volume": 95.64105183092526,
"volume_molar": 9.599397942671462,
"formula_full": "Be1 Ir4 Pt1",
"formula_reduced": "BeIr4Pt",
"formula_anonymous": "ABC4",
"energy_above_hull": 4.356615316666666,
"spacegroup": 216
},
{
"id": "jvasp-86364",
"created_at": "2022-09-04T14:36:12.898067Z",
"updated_at": "2022-09-04T14:36:12.898094Z",
"structure_string": "Ga4 Pd8\n1.0\n4.084069 0.000000 0.000000\n-0.000000 5.603906 0.000000\n0.000000 0.000000 7.870269\nGa Pd\n4 8\ndirect\n0.750000 0.706928 0.891539 Ga\n0.250000 0.293072 0.108461 Ga\n0.750000 0.206928 0.608461 Ga\n0.250000 0.793073 0.391539 Ga\n0.750000 0.662579 0.566526 Pd\n0.250000 0.337421 0.433474 Pd\n0.750000 0.162579 0.933474 Pd\n0.250000 0.837422 0.066526 Pd\n0.750000 0.541231 0.206091 Pd\n0.250000 0.458769 0.793909 Pd\n0.750000 0.041231 0.293909 Pd\n0.250000 0.958770 0.706091 Pd\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Ga",
"Pd"
],
"chemical_system": "Ga-Pd",
"density": 10.419596292184352,
"density_atomic": 0.06662047991661263,
"volume": 180.1247906802853,
"volume_molar": 9.039473698685118,
"formula_full": "Ga4 Pd8",
"formula_reduced": "GaPd2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.6538812416666667,
"spacegroup": 62
},
{
"id": "jvasp-66687",
"created_at": "2022-09-04T14:36:12.895793Z",
"updated_at": "2022-09-04T14:36:12.895817Z",
"structure_string": "Ba4 Si1 Pt1\n1.0\n0.000000 4.754056 4.754056\n4.754056 0.000000 4.754056\n4.754056 4.754056 0.000000\nBa Si Pt\n4 1 1\ndirect\n0.125620 0.624794 0.624794 Ba\n0.624794 0.624794 0.624794 Ba\n0.624794 0.125620 0.624794 Ba\n0.624794 0.624794 0.125620 Ba\n0.000000 0.000000 0.000000 Si\n0.250000 0.250000 0.250000 Pt\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Si",
"Pt"
],
"chemical_system": "Ba-Pt-Si",
"density": 5.9691440676570755,
"density_atomic": 0.027920833270539843,
"volume": 214.89329999082764,
"volume_molar": 21.568628348761184,
"formula_full": "Ba4 Si1 Pt1",
"formula_reduced": "Ba4SiPt",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.9736756466666664,
"spacegroup": 216
},
{
"id": "jvasp-62103",
"created_at": "2022-09-04T14:36:12.895581Z",
"updated_at": "2022-09-04T14:36:12.895608Z",
"structure_string": "Mg12 Al4 Pt8\n1.0\n-0.000000 5.940769 5.940769\n5.940769 -0.000000 5.940769\n5.940769 5.940769 0.000000\nMg Al Pt\n12 4 8\ndirect\n0.947990 0.552010 0.947990 Mg\n0.552010 0.947990 0.947990 Mg\n0.947990 0.552010 0.552010 Mg\n0.947990 0.947990 0.552010 Mg\n0.802010 0.802010 0.197990 Mg\n0.197990 0.197990 0.802010 Mg\n0.802010 0.197990 0.802010 Mg\n0.197990 0.802010 0.197990 Mg\n0.802010 0.197990 0.197990 Mg\n0.197990 0.802010 0.802010 Mg\n0.552010 0.947990 0.552010 Mg\n0.552010 0.552010 0.947990 Mg\n0.875000 0.375000 0.375000 Al\n0.375000 0.875000 0.375000 Al\n0.375000 0.375000 0.875000 Al\n0.375000 0.375000 0.375000 Al\n0.527065 0.157645 0.157645 Pt\n0.157645 0.157645 0.157645 Pt\n0.157645 0.157645 0.527065 Pt\n0.157645 0.527065 0.157645 Pt\n0.592355 0.592355 0.592355 Pt\n0.222935 0.592355 0.592355 Pt\n0.592355 0.592355 0.222935 Pt\n0.592355 0.222935 0.592355 Pt\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Mg",
"Al",
"Pt"
],
"chemical_system": "Al-Mg-Pt",
"density": 7.7625493456270025,
"density_atomic": 0.05723388796771004,
"volume": 419.3319876074156,
"volume_molar": 10.521984393926802,
"formula_full": "Mg12 Al4 Pt8",
"formula_reduced": "Mg3AlPt2",
"formula_anonymous": "AB2C3",
"energy_above_hull": 0.6710954583333333,
"spacegroup": 227
},
{
"id": "jvasp-65721",
"created_at": "2022-09-04T14:36:12.894010Z",
"updated_at": "2022-09-04T14:36:12.894038Z",
"structure_string": "Ba2 Tl1 Zn1\n1.0\n-0.000000 4.175669 4.175669\n4.175669 0.000000 4.175669\n4.175669 4.175669 0.000000\nBa Tl Zn\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Ba\n0.750000 0.750000 0.750000 Ba\n0.000000 0.000000 0.000000 Tl\n0.500000 0.500000 0.500000 Zn\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"Tl",
"Zn"
],
"chemical_system": "Ba-Tl-Zn",
"density": 6.208632534839686,
"density_atomic": 0.02746956610034167,
"volume": 145.6156964907519,
"volume_molar": 21.92295552831865,
"formula_full": "Ba2 Tl1 Zn1",
"formula_reduced": "Ba2TlZn",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
}
]
}