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=67",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=nelements&page=65",
"results": [
{
"id": "jvasp-101636",
"created_at": "2022-09-04T14:36:41.985554Z",
"updated_at": "2022-09-04T14:36:41.985580Z",
"structure_string": "Hf2 Ni7\n1.0\n4.649563 -0.000951 0.649172\n-2.511188 3.913102 0.649172\n0.004302 0.007870 6.250159\nHf Ni\n2 7\ndirect\n0.108478 0.108478 0.227857 Hf\n0.891521 0.891522 0.772143 Hf\n-0.000000 0.500000 0.500000 Ni\n0.500000 0.000000 0.500000 Ni\n0.467184 0.794575 0.154566 Ni\n0.532814 0.205425 0.845434 Ni\n0.205424 0.532815 0.845434 Ni\n0.794575 0.467185 0.154566 Ni\n0.499999 0.500000 0.500000 Ni\n",
"nsites": 9,
"nelements": 2,
"elements": [
"Hf",
"Ni"
],
"chemical_system": "Hf-Ni",
"density": 11.218388791611565,
"density_atomic": 0.07918750748424229,
"volume": 113.65429075780585,
"volume_molar": 7.604912632460821,
"formula_full": "Hf2 Ni7",
"formula_reduced": "Hf2Ni7",
"formula_anonymous": "A2B7",
"energy_above_hull": 2.3401214222222224,
"spacegroup": 12
},
{
"id": "jvasp-36222",
"created_at": "2022-09-04T14:36:42.148192Z",
"updated_at": "2022-09-04T14:36:42.148220Z",
"structure_string": "Ti1 O2\n1.0\n2.413397 2.413397 -0.000000\n2.413397 -0.000000 -2.413397\n0.000000 2.413397 -2.413397\nTi O\n1 2\ndirect\n0.000000 0.000000 0.000000 Ti\n0.250000 0.250000 0.250000 O\n0.750001 0.750001 0.750001 O\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Ti",
"O"
],
"chemical_system": "O-Ti",
"density": 4.717301586366027,
"density_atomic": 0.10670995909494975,
"volume": 28.113589635346234,
"volume_molar": 5.64346646843107,
"formula_full": "Ti1 O2",
"formula_reduced": "TiO2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.5606784444444446,
"spacegroup": 225
},
{
"id": "jvasp-102991",
"created_at": "2022-09-04T14:36:41.994186Z",
"updated_at": "2022-09-04T14:36:41.994209Z",
"structure_string": "Te2 Pb6\n1.0\n6.944383 -0.000000 0.000000\n-3.472190 6.014013 0.000000\n0.000000 0.000000 6.055111\nTe Pb\n2 6\ndirect\n0.333333 0.666667 0.750000 Te\n0.666667 0.333333 0.250000 Te\n0.166539 0.333077 0.250000 Pb\n0.666922 0.833461 0.250000 Pb\n0.166538 0.833461 0.250000 Pb\n0.833461 0.666922 0.750000 Pb\n0.333077 0.166539 0.750000 Pb\n0.833461 0.166539 0.750000 Pb\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Te",
"Pb"
],
"chemical_system": "Pb-Te",
"density": 9.83913059850004,
"density_atomic": 0.03163514652464854,
"volume": 252.8832921246878,
"volume_molar": 19.03623476283837,
"formula_full": "Te2 Pb6",
"formula_reduced": "TePb3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.4097900566666666,
"spacegroup": 194
},
{
"id": "jvasp-104561",
"created_at": "2022-09-04T14:36:42.110324Z",
"updated_at": "2022-09-04T14:36:42.110350Z",
"structure_string": "Dy5 Mg1\n1.0\n5.370669 0.001387 3.710108\n1.947054 5.005304 3.710108\n0.002027 0.001387 6.527556\nDy Mg\n5 1\ndirect\n0.500000 0.158421 0.841579 Dy\n0.158421 0.841579 0.500001 Dy\n0.841579 0.500000 0.158421 Dy\n0.333279 0.333279 0.333279 Dy\n0.666721 0.666721 0.666722 Dy\n0.000000 0.000000 0.000000 Mg\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Dy",
"Mg"
],
"chemical_system": "Dy-Mg",
"density": 7.922172943114905,
"density_atomic": 0.03420756850519903,
"volume": 175.3997802880404,
"volume_molar": 17.60470276946088,
"formula_full": "Dy5 Mg1",
"formula_reduced": "Dy5Mg",
"formula_anonymous": "AB5",
"energy_above_hull": 1.2133117222222225,
"spacegroup": 155
},
{
"id": "jvasp-19913",
"created_at": "2022-09-04T14:36:42.032336Z",
"updated_at": "2022-09-04T14:36:42.032356Z",
"structure_string": "Nb1 Zn3\n1.0\n3.944981 -0.000000 0.000000\n0.000000 3.944981 -0.000000\n0.000000 -0.000000 3.944981\nNb Zn\n1 3\ndirect\n0.000000 0.000000 0.000000 Nb\n0.500000 0.000000 0.500000 Zn\n0.000000 0.500000 0.500000 Zn\n0.500000 0.500000 0.000000 Zn\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Nb",
"Zn"
],
"chemical_system": "Nb-Zn",
"density": 7.82010497604163,
"density_atomic": 0.06515162371079218,
"volume": 61.395246536847424,
"volume_molar": 9.243270415994942,
"formula_full": "Nb1 Zn3",
"formula_reduced": "NbZn3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.1482251499999998,
"spacegroup": 221
},
{
"id": "jvasp-102127",
"created_at": "2022-09-04T14:36:41.954016Z",
"updated_at": "2022-09-04T14:36:41.954041Z",
"structure_string": "Sm1 Zr1\n1.0\n3.373512 -0.000000 0.000000\n-1.686756 2.921547 -0.000000\n-0.000000 0.000000 5.514109\nSm Zr\n1 1\ndirect\n0.333332 0.666668 0.500000 Sm\n0.000000 0.000000 0.000000 Zr\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Sm",
"Zr"
],
"chemical_system": "Sm-Zr",
"density": 7.38153667347516,
"density_atomic": 0.03680099086705366,
"volume": 54.34636277118597,
"volume_molar": 16.36407232010528,
"formula_full": "Sm1 Zr1",
"formula_reduced": "SmZr",
"formula_anonymous": "AB",
"energy_above_hull": 2.0262216875,
"spacegroup": 187
},
{
"id": "jvasp-102519",
"created_at": "2022-09-04T14:36:42.252534Z",
"updated_at": "2022-09-04T14:36:42.252556Z",
"structure_string": "Li6 Tm2\n1.0\n6.405760 0.000000 0.000000\n-3.202881 5.547551 0.000000\n-0.000000 -0.000000 5.055041\nLi Tm\n6 2\ndirect\n0.155806 0.311611 0.250000 Li\n0.688389 0.844194 0.250000 Li\n0.155806 0.844194 0.250000 Li\n0.844194 0.688389 0.750000 Li\n0.311611 0.155806 0.750000 Li\n0.844194 0.155806 0.750000 Li\n0.333333 0.666667 0.750000 Tm\n0.666667 0.333333 0.250000 Tm\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Li",
"Tm"
],
"chemical_system": "Li-Tm",
"density": 3.5081708072559987,
"density_atomic": 0.04453416746319023,
"volume": 179.63735387244884,
"volume_molar": 13.522517884672725,
"formula_full": "Li6 Tm2",
"formula_reduced": "Li3Tm",
"formula_anonymous": "AB3",
"energy_above_hull": 0.9032460625,
"spacegroup": 194
},
{
"id": "jvasp-102331",
"created_at": "2022-09-04T14:36:34.970106Z",
"updated_at": "2022-09-04T14:36:34.970130Z",
"structure_string": "Mo1 Pt1\n1.0\n2.812373 0.000000 0.000000\n-1.406187 2.435586 0.000000\n0.000000 0.000000 4.540236\nMo Pt\n1 1\ndirect\n0.666666 0.333334 -0.000000 Mo\n0.333333 0.666668 0.500000 Pt\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Mo",
"Pt"
],
"chemical_system": "Mo-Pt",
"density": 15.539000700167886,
"density_atomic": 0.06430950678877903,
"volume": 31.099600974532237,
"volume_molar": 9.364308732423314,
"formula_full": "Mo1 Pt1",
"formula_reduced": "MoPt",
"formula_anonymous": "AB",
"energy_above_hull": 2.7764486499999994,
"spacegroup": 187
},
{
"id": "jvasp-88679",
"created_at": "2022-09-04T14:35:59.218080Z",
"updated_at": "2022-09-04T14:35:59.218112Z",
"structure_string": "Au4 Cl8\n1.0\n6.443764 0.130723 2.071744\n0.581389 6.674062 0.320643\n0.035978 0.118373 7.107896\nAu Cl\n4 8\ndirect\n0.735962 0.516637 0.468667 Au\n0.264038 0.483361 0.531332 Au\n0.638002 0.234164 0.088519 Au\n0.361998 0.765835 0.911480 Au\n0.851619 0.219356 0.298989 Cl\n0.148381 0.780643 0.701010 Cl\n0.343142 0.181190 0.371985 Cl\n0.656858 0.818808 0.628014 Cl\n0.427020 0.258417 0.885503 Cl\n0.572980 0.741582 0.114496 Cl\n0.925031 0.287692 0.817321 Cl\n0.074968 0.712307 0.182679 Cl\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Au",
"Cl"
],
"chemical_system": "Au-Cl",
"density": 5.842334905862254,
"density_atomic": 0.03940309750303973,
"volume": 304.54458558935033,
"volume_molar": 15.283419684291127,
"formula_full": "Au4 Cl8",
"formula_reduced": "AuCl2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.104755235,
"spacegroup": 2
},
{
"id": "jvasp-57883",
"created_at": "2022-09-04T14:36:35.107930Z",
"updated_at": "2022-09-04T14:36:35.107955Z",
"structure_string": "Ti12 O2\n1.0\n5.091925 -0.000000 0.000000\n-2.545962 4.409736 -0.000000\n-0.000000 -0.000000 9.481301\nTi O\n12 2\ndirect\n0.668237 0.668237 0.130603 Ti\n0.000001 0.668237 0.369397 Ti\n0.668236 0.000000 0.369397 Ti\n0.331763 0.331763 0.369397 Ti\n0.668236 0.000000 0.869397 Ti\n0.000001 0.668237 0.869397 Ti\n0.331763 0.331763 0.869397 Ti\n0.000000 0.331763 0.630603 Ti\n0.331763 0.000000 0.630603 Ti\n0.668237 0.668237 0.630603 Ti\n0.000000 0.331763 0.130603 Ti\n0.331763 0.000000 0.130603 Ti\n0.000000 0.000000 0.500000 O\n0.000000 0.000000 0.000000 O\n",
"nsites": 14,
"nelements": 2,
"elements": [
"Ti",
"O"
],
"chemical_system": "O-Ti",
"density": 4.729854409703002,
"density_atomic": 0.0657605615527076,
"volume": 212.8935591399853,
"volume_molar": 9.157678428845545,
"formula_full": "Ti12 O2",
"formula_reduced": "Ti6O",
"formula_anonymous": "AB6",
"energy_above_hull": 4.014463357142858,
"spacegroup": 162
},
{
"id": "jvasp-49807",
"created_at": "2022-09-04T14:36:42.041093Z",
"updated_at": "2022-09-04T14:36:42.041104Z",
"structure_string": "Hf3 N4\n1.0\n-0.701486 3.330231 0.000000\n-7.925823 -3.408508 -0.046529\n-0.701486 1.591234 2.925476\nHf N\n3 4\ndirect\n0.444229 0.666345 0.777886 Hf\n0.555769 0.333655 0.222115 Hf\n0.000000 0.000000 0.000000 Hf\n0.243680 0.865522 0.378159 N\n0.735426 0.603142 0.132286 N\n0.264571 0.396859 0.867716 N\n0.756318 0.134479 0.621842 N\n",
"nsites": 7,
"nelements": 2,
"elements": [
"Hf",
"N"
],
"chemical_system": "Hf-N",
"density": 11.655566819931797,
"density_atomic": 0.08306727075451646,
"volume": 84.26905008937473,
"volume_molar": 7.249715447852932,
"formula_full": "Hf3 N4",
"formula_reduced": "Hf3N4",
"formula_anonymous": "A3B4",
"energy_above_hull": 5.785796,
"spacegroup": 166
},
{
"id": "jvasp-104842",
"created_at": "2022-09-04T14:36:42.175052Z",
"updated_at": "2022-09-04T14:36:42.175083Z",
"structure_string": "Cr1 H3\n1.0\n2.741326 -0.000000 0.000000\n0.000000 2.741326 0.000000\n0.000000 -0.000000 2.741326\nCr H\n1 3\ndirect\n0.000000 0.000000 0.000000 Cr\n-0.000000 0.500001 0.500001 H\n0.500001 0.000000 0.500001 H\n0.500001 0.500001 -0.000000 H\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Cr",
"H"
],
"chemical_system": "Cr-H",
"density": 4.434932319992322,
"density_atomic": 0.1941681245723132,
"volume": 20.60070368816019,
"volume_molar": 3.1015084341287955,
"formula_full": "Cr1 H3",
"formula_reduced": "CrH3",
"formula_anonymous": "AB3",
"energy_above_hull": 3.18620685,
"spacegroup": 221
}
]
}