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=3490",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-created_at&page=3488",
"results": [
{
"id": "jvasp-73709",
"created_at": "2022-09-04T14:36:19.261958Z",
"updated_at": "2022-09-04T14:36:19.261979Z",
"structure_string": "Be2 Cr1 Cu1\n1.0\n-1.925893 1.925893 2.723697\n1.925893 -1.925893 2.723697\n1.925893 1.925893 -2.723697\nBe Cr Cu\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Be\n0.500001 0.500001 0.000000 Be\n0.250000 0.749999 0.499999 Cr\n0.749999 0.250000 0.499999 Cu\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Cr",
"Cu"
],
"chemical_system": "Be-Cr-Cu",
"density": 5.488623403484841,
"density_atomic": 0.0989867118915074,
"volume": 40.4094642964212,
"volume_molar": 6.083787050731071,
"formula_full": "Be2 Cr1 Cu1",
"formula_reduced": "Be2CrCu",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.0280900125,
"spacegroup": 225
},
{
"id": "jvasp-90062",
"created_at": "2022-09-04T14:36:19.259069Z",
"updated_at": "2022-09-04T14:36:19.259079Z",
"structure_string": "Sc3 Si3 Ru3\n1.0\n0.000000 0.000000 -3.399136\n-3.454955 -5.984158 0.000000\n-3.454985 5.984175 0.000000\nSc Si Ru\n3 3 3\ndirect\n0.500001 0.598088 -0.000000 Sc\n0.500001 0.401891 0.401901 Sc\n0.500001 -0.000011 0.598099 Sc\n0.000000 0.333322 0.666665 Si\n0.000000 0.666657 0.333334 Si\n0.500001 -0.000014 0.000000 Si\n0.000000 0.252403 -0.000000 Ru\n0.000000 0.747572 0.747584 Ru\n0.000000 0.999987 0.252414 Ru\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Sc",
"Si",
"Ru"
],
"chemical_system": "Ru-Sc-Si",
"density": 6.170936872387151,
"density_atomic": 0.0640318461367117,
"volume": 140.55506038018143,
"volume_molar": 9.404915090441687,
"formula_full": "Sc3 Si3 Ru3",
"formula_reduced": "ScSiRu",
"formula_anonymous": "ABC",
"energy_above_hull": 2.732778116666667,
"spacegroup": 189
},
{
"id": "jvasp-85884",
"created_at": "2022-09-04T14:36:19.254227Z",
"updated_at": "2022-09-04T14:36:19.254243Z",
"structure_string": "Ti9 Ni9\n1.0\n7.271455 -0.000001 0.000000\n-3.635727 6.297266 -0.000000\n0.000000 -0.000000 5.323757\nTi Ni\n9 9\ndirect\n0.000000 0.000000 0.000000 Ti\n0.986406 0.655666 0.653301 Ti\n0.669260 0.013595 0.653301 Ti\n0.655666 0.669260 0.346699 Ti\n0.344335 0.330740 0.653301 Ti\n0.330740 0.986406 0.346699 Ti\n0.666667 0.333333 0.953732 Ti\n0.333333 0.666667 0.046269 Ti\n0.013595 0.344335 0.346699 Ti\n0.973059 0.659946 0.140574 Ni\n0.000000 0.000000 0.500000 Ni\n0.333333 0.666667 0.587990 Ni\n0.666667 0.333333 0.412011 Ni\n0.313113 0.973059 0.859426 Ni\n0.026942 0.340055 0.859426 Ni\n0.659946 0.686888 0.859426 Ni\n0.686888 0.026942 0.140574 Ni\n0.340055 0.313113 0.140574 Ni\n",
"nsites": 18,
"nelements": 2,
"elements": [
"Ti",
"Ni"
],
"chemical_system": "Ni-Ti",
"density": 6.532747914963677,
"density_atomic": 0.07383817535801898,
"volume": 243.7763380896595,
"volume_molar": 8.155863455184884,
"formula_full": "Ti9 Ni9",
"formula_reduced": "TiNi",
"formula_anonymous": "AB",
"energy_above_hull": 1.4206953666666666,
"spacegroup": 147
},
{
"id": "jvasp-64419",
"created_at": "2022-09-04T14:36:19.248406Z",
"updated_at": "2022-09-04T14:36:19.248434Z",
"structure_string": "Ba4 Zr1 Se1\n1.0\n0.000000 4.990188 4.990188\n4.990188 0.000000 4.990188\n4.990188 4.990188 -0.000000\nBa Zr Se\n4 1 1\ndirect\n0.126272 0.624576 0.624576 Ba\n0.624576 0.624576 0.624576 Ba\n0.624576 0.126272 0.624576 Ba\n0.624576 0.624576 0.126272 Ba\n0.000000 0.000000 0.000000 Zr\n0.250000 0.250000 0.250000 Se\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Zr",
"Se"
],
"chemical_system": "Ba-Se-Zr",
"density": 4.8072238831428376,
"density_atomic": 0.024141849165070117,
"volume": 248.5310863710126,
"volume_molar": 24.94481975603259,
"formula_full": "Ba4 Zr1 Se1",
"formula_reduced": "Ba4ZrSe",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.9512202911111112,
"spacegroup": 216
},
{
"id": "jvasp-66397",
"created_at": "2022-09-04T14:36:19.247135Z",
"updated_at": "2022-09-04T14:36:19.247165Z",
"structure_string": "Ba1 Li1 Zn1\n1.0\n0.000000 3.890042 3.890042\n3.890042 0.000000 3.890042\n3.890042 3.890042 -0.000000\nBa Li Zn\n1 1 1\ndirect\n0.750000 0.750000 0.750000 Ba\n0.000000 0.000000 0.000000 Li\n0.500000 0.500000 0.500000 Zn\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ba",
"Li",
"Zn"
],
"chemical_system": "Ba-Li-Zn",
"density": 2.9573792745706124,
"density_atomic": 0.025481699392387702,
"volume": 117.73155133037193,
"volume_molar": 23.633199133488834,
"formula_full": "Ba1 Li1 Zn1",
"formula_reduced": "BaLiZn",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0069834,
"spacegroup": 216
},
{
"id": "jvasp-68986",
"created_at": "2022-09-04T14:36:19.244469Z",
"updated_at": "2022-09-04T14:36:19.244487Z",
"structure_string": "K1 Ba2 Pd1\n1.0\n-0.000000 4.194104 4.194104\n4.194104 -0.000000 4.194104\n4.194104 4.194104 0.000000\nK Ba Pd\n1 2 1\ndirect\n0.000000 0.000000 0.000000 K\n0.250000 0.250000 0.250000 Ba\n0.749999 0.749999 0.749999 Ba\n0.500000 0.500000 0.500000 Pd\n",
"nsites": 4,
"nelements": 3,
"elements": [
"K",
"Ba",
"Pd"
],
"chemical_system": "Ba-K-Pd",
"density": 4.728560323169487,
"density_atomic": 0.027108932091066885,
"volume": 147.5528429730401,
"volume_molar": 22.21459974804561,
"formula_full": "K1 Ba2 Pd1",
"formula_reduced": "KBa2Pd",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.05310891,
"spacegroup": 225
},
{
"id": "jvasp-18710",
"created_at": "2022-09-04T14:36:19.244201Z",
"updated_at": "2022-09-04T14:36:19.244225Z",
"structure_string": "Ti4 Ga2\n1.0\n2.260576 -3.915433 -0.000000\n2.260576 3.915433 0.000000\n-0.000000 0.000000 5.421285\nTi Ga\n4 2\ndirect\n0.666668 0.333334 0.250000 Ti\n0.333334 0.666668 0.750001 Ti\n0.000000 0.000000 0.000000 Ti\n0.000000 0.000000 0.500000 Ti\n0.666668 0.333334 0.750001 Ga\n0.333334 0.666668 0.250000 Ga\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Ti",
"Ga"
],
"chemical_system": "Ga-Ti",
"density": 5.725759400520959,
"density_atomic": 0.06252016369161735,
"volume": 95.9690385584271,
"volume_molar": 9.632317646678592,
"formula_full": "Ti4 Ga2",
"formula_reduced": "Ti2Ga",
"formula_anonymous": "AB2",
"energy_above_hull": 2.0036063305555567,
"spacegroup": 194
},
{
"id": "jvasp-43180",
"created_at": "2022-09-04T14:36:19.236025Z",
"updated_at": "2022-09-04T14:36:19.236053Z",
"structure_string": "Cr3 Ni1 P4 O16\n1.0\n0.000000 4.694010 -0.004418\n5.634675 0.000000 0.000000\n0.000000 -0.039537 -9.736942\nCr Ni P O\n3 1 4 16\ndirect\n0.448940 0.500000 0.229408 Cr\n0.557339 0.000000 0.769497 Cr\n0.945789 0.000000 0.267685 Cr\n0.060331 0.500000 0.730978 Ni\n0.125953 0.000000 0.588505 P\n0.383261 0.000000 0.084592 P\n0.603542 0.500000 0.913335 P\n0.886155 0.500000 0.413580 P\n0.731113 0.288382 0.332578 O\n0.806878 0.000000 0.616100 O\n0.703006 0.000000 0.108685 O\n0.750912 0.716777 0.837787 O\n0.750912 0.283224 0.837787 O\n0.681704 0.500000 0.066711 O\n0.313661 0.000000 0.932366 O\n0.205350 0.500000 0.385801 O\n0.230739 0.788325 0.164158 O\n0.283536 0.500000 0.897452 O\n0.731113 0.711618 0.332578 O\n0.285669 0.209883 0.664055 O\n0.285669 0.790118 0.664055 O\n0.177540 0.000000 0.434117 O\n0.230739 0.211676 0.164158 O\n0.820137 0.500000 0.564031 O\n",
"nsites": 24,
"nelements": 4,
"elements": [
"Cr",
"Ni",
"P",
"O"
],
"chemical_system": "Cr-Ni-O-P",
"density": 3.8336537170148284,
"density_atomic": 0.09319103106694546,
"volume": 257.53551307699524,
"volume_molar": 6.462146293535358,
"formula_full": "Cr3 Ni1 P4 O16",
"formula_reduced": "Cr3Ni(PO4)4",
"formula_anonymous": "AB3C4D16",
"energy_above_hull": 3.415700108333334,
"spacegroup": 6
},
{
"id": "jvasp-89202",
"created_at": "2022-09-04T14:36:19.233304Z",
"updated_at": "2022-09-04T14:36:19.233335Z",
"structure_string": "Hg8 Se4 O12\n1.0\n5.149390 0.000000 0.000000\n0.000000 8.392357 -2.114317\n0.000000 0.001142 10.492048\nHg Se O\n8 4 12\ndirect\n0.730504 0.158812 0.593419 Hg\n0.269496 0.841188 0.406581 Hg\n0.769496 0.658812 0.093419 Hg\n0.797423 0.107898 0.341176 Hg\n0.702577 0.607899 0.841176 Hg\n0.202577 0.892102 0.658824 Hg\n0.297423 0.392102 0.158824 Hg\n0.230504 0.341188 0.906581 Hg\n0.243779 0.464395 0.620049 Se\n0.756221 0.535605 0.379950 Se\n0.743779 0.035604 0.879951 Se\n0.256221 0.964396 0.120049 Se\n0.165553 0.309773 0.694790 O\n0.653328 0.870442 0.762471 O\n0.153329 0.629558 0.737529 O\n0.346671 0.129558 0.237529 O\n0.419279 0.525086 0.361176 O\n0.080721 0.025086 0.861176 O\n0.580721 0.474914 0.638824 O\n0.334447 0.809773 0.194789 O\n0.834447 0.690227 0.305210 O\n0.665553 0.190227 0.805211 O\n0.846671 0.370442 0.262471 O\n0.919279 0.974914 0.138824 O\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Hg",
"Se",
"O"
],
"chemical_system": "Hg-O-Se",
"density": 7.736504044474261,
"density_atomic": 0.05292968737603217,
"volume": 453.43173537933603,
"volume_molar": 11.377623897939309,
"formula_full": "Hg8 Se4 O12",
"formula_reduced": "Hg2SeO3",
"formula_anonymous": "AB2C3",
"energy_above_hull": 0.8854171777777776,
"spacegroup": 14
},
{
"id": "jvasp-67760",
"created_at": "2022-09-04T14:36:19.228778Z",
"updated_at": "2022-09-04T14:36:19.228813Z",
"structure_string": "Sr1 Be1 V2\n1.0\n3.180796 0.000000 -0.000000\n-0.000000 3.180796 0.000000\n-0.000000 -0.000000 7.194623\nSr Be V\n1 1 2\ndirect\n0.500001 0.500001 0.736031 Sr\n0.000000 0.000000 0.414028 Be\n0.000000 0.000000 0.097185 V\n0.500001 0.500001 0.252755 V\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sr",
"Be",
"V"
],
"chemical_system": "Be-Sr-V",
"density": 4.528591518415211,
"density_atomic": 0.05495159675568409,
"volume": 72.79133339444313,
"volume_molar": 10.958991395235628,
"formula_full": "Sr1 Be1 V2",
"formula_reduced": "SrBeV2",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.6043152025,
"spacegroup": 99
},
{
"id": "jvasp-75019",
"created_at": "2022-09-04T14:36:19.223533Z",
"updated_at": "2022-09-04T14:36:19.223561Z",
"structure_string": "Be1 Re1 Cl4\n1.0\n0.000000 4.098676 4.098676\n4.098676 0.000000 4.098676\n4.098676 4.098676 0.000000\nBe Re Cl\n1 1 4\ndirect\n0.000000 0.000000 0.000000 Be\n0.250000 0.250000 0.250000 Re\n0.126916 0.624362 0.624362 Cl\n0.624362 0.624362 0.624362 Cl\n0.624362 0.126916 0.624362 Cl\n0.624362 0.624362 0.126916 Cl\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Be",
"Re",
"Cl"
],
"chemical_system": "Be-Cl-Re",
"density": 4.064044167006958,
"density_atomic": 0.04357029380806187,
"volume": 137.70850447856773,
"volume_molar": 13.821666630317086,
"formula_full": "Be1 Re1 Cl4",
"formula_reduced": "BeReCl4",
"formula_anonymous": "ABC4",
"energy_above_hull": 1.9574400616666665,
"spacegroup": 216
},
{
"id": "jvasp-91379",
"created_at": "2022-09-04T14:36:19.220127Z",
"updated_at": "2022-09-04T14:36:19.220162Z",
"structure_string": "Li8 Y8 Sn8\n1.0\n9.307578 0.000000 -0.000000\n-4.653790 8.060599 0.000000\n0.000000 -0.000000 7.344808\nLi Y Sn\n8 8 8\ndirect\n0.166798 0.833202 0.196834 Li\n0.333597 0.166798 0.696834 Li\n0.833202 0.666403 0.696834 Li\n0.166798 0.333597 0.196834 Li\n0.666403 0.833202 0.196834 Li\n0.833202 0.166798 0.696834 Li\n0.333333 0.666667 0.808661 Li\n0.666667 0.333333 0.308661 Li\n0.000000 0.000000 0.485648 Y\n0.000000 0.000000 0.985649 Y\n0.488455 0.511545 0.490750 Y\n0.976911 0.488455 0.990751 Y\n0.511545 0.023089 0.990751 Y\n0.488455 0.976911 0.490750 Y\n0.023089 0.511545 0.490750 Y\n0.511545 0.488455 0.990751 Y\n0.166732 0.833268 0.754516 Sn\n0.333464 0.166732 0.254516 Sn\n0.833268 0.666536 0.254516 Sn\n0.166732 0.333464 0.754516 Sn\n0.666536 0.833268 0.754516 Sn\n0.833268 0.166732 0.254516 Sn\n0.333333 0.666667 0.224393 Sn\n0.666667 0.333333 0.724393 Sn\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Li",
"Y",
"Sn"
],
"chemical_system": "Li-Sn-Y",
"density": 5.172458570157639,
"density_atomic": 0.043553874316558286,
"volume": 551.041678303133,
"volume_molar": 13.826877297367105,
"formula_full": "Li8 Y8 Sn8",
"formula_reduced": "LiYSn",
"formula_anonymous": "ABC",
"energy_above_hull": 0.9484123833333332,
"spacegroup": 186
}
]
}