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=-formula_anonymous&page=3869",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-formula_anonymous&page=3867",
"results": [
{
"id": "jvasp-35839",
"created_at": "2022-09-04T14:37:30.187047Z",
"updated_at": "2022-09-04T14:37:30.187075Z",
"structure_string": "Ce2 S4\n1.0\n4.112749 -0.000000 0.000000\n-0.000000 4.112749 -0.000000\n-0.000000 -0.000000 7.525282\nCe S\n2 4\ndirect\n0.500000 0.000000 0.743310 Ce\n0.000000 0.500000 0.256690 Ce\n0.500000 0.000000 0.365556 S\n0.000000 0.500000 0.634444 S\n0.500000 0.500000 0.000000 S\n0.000000 0.000000 0.000000 S\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Ce",
"S"
],
"chemical_system": "Ce-S",
"density": 5.328996843955254,
"density_atomic": 0.04713723027376487,
"volume": 127.28792008255554,
"volume_molar": 12.775762863079672,
"formula_full": "Ce2 S4",
"formula_reduced": "CeS2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.1384085000000002,
"spacegroup": 129
},
{
"id": "jvasp-20405",
"created_at": "2022-09-04T14:37:37.587347Z",
"updated_at": "2022-09-04T14:37:37.587375Z",
"structure_string": "Mg12 Ni6\n1.0\n2.594372 -4.493584 -0.000000\n2.594372 4.493584 0.000000\n-0.000000 -0.000000 13.136000\nMg Ni\n12 6\ndirect\n0.500000 0.500000 0.717195 Mg\n0.835835 0.164164 0.833333 Mg\n0.164164 0.328330 0.500000 Mg\n0.671669 0.835835 0.166667 Mg\n0.835835 0.671669 0.500000 Mg\n0.164164 0.835835 0.833333 Mg\n0.328330 0.164164 0.166667 Mg\n0.500000 0.000000 0.616138 Mg\n0.500000 0.500000 0.949472 Mg\n0.000000 0.500000 0.050528 Mg\n0.500000 0.000000 0.383862 Mg\n0.000000 0.500000 0.282805 Mg\n0.500000 0.500000 0.333333 Ni\n0.000000 0.000000 0.666667 Ni\n0.000000 0.000000 0.333333 Ni\n0.000000 0.000000 0.000000 Ni\n0.000000 0.500000 0.666667 Ni\n0.500000 0.000000 0.000000 Ni\n",
"nsites": 18,
"nelements": 2,
"elements": [
"Mg",
"Ni"
],
"chemical_system": "Mg-Ni",
"density": 3.49056381741109,
"density_atomic": 0.05876980593572101,
"volume": 306.27972499496343,
"volume_molar": 10.246997865854222,
"formula_full": "Mg12 Ni6",
"formula_reduced": "Mg2Ni",
"formula_anonymous": "AB2",
"energy_above_hull": 0.2744024761904762,
"spacegroup": 180
},
{
"id": "jvasp-56330",
"created_at": "2022-09-04T14:37:30.156152Z",
"updated_at": "2022-09-04T14:37:30.156170Z",
"structure_string": "Zr4 Ga2\n1.0\n4.742842 0.000000 2.718254\n2.371421 4.726544 1.359127\n0.021148 0.000000 5.459913\nZr Ga\n4 2\ndirect\n0.346334 0.807331 0.500000 Zr\n0.153667 0.500000 0.192668 Zr\n0.653666 0.192668 0.499999 Zr\n0.846333 0.500000 0.807331 Zr\n0.250000 -0.000000 -0.000000 Ga\n0.750000 -0.000000 -0.000000 Ga\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Zr",
"Ga"
],
"chemical_system": "Ga-Zr",
"density": 6.857586816210218,
"density_atomic": 0.04913017725520738,
"volume": 122.12453394647687,
"volume_molar": 12.257518894584702,
"formula_full": "Zr4 Ga2",
"formula_reduced": "Zr2Ga",
"formula_anonymous": "AB2",
"energy_above_hull": 2.268673775000001,
"spacegroup": 140
},
{
"id": "jvasp-36578",
"created_at": "2022-09-04T14:37:30.137319Z",
"updated_at": "2022-09-04T14:37:30.137345Z",
"structure_string": "Cr8 N16\n1.0\n-8.170521 -8.170521 0.000000\n-8.170521 0.000000 -8.170521\n-0.000000 -8.170521 -8.170521\nCr N\n8 16\ndirect\n0.435830 0.692510 0.435830 Cr\n0.435830 0.435830 0.435830 Cr\n0.435830 0.435830 0.692510 Cr\n0.692510 0.435830 0.435830 Cr\n0.314170 0.057489 0.314170 Cr\n0.314170 0.314170 0.314170 Cr\n0.314170 0.314170 0.057489 Cr\n0.057489 0.314170 0.314170 Cr\n0.375000 0.375000 0.375000 N\n0.375000 0.875000 0.375000 N\n0.128952 0.128952 0.371048 N\n0.128952 0.371048 0.128952 N\n0.128952 0.371048 0.371048 N\n0.371048 0.128952 0.371048 N\n0.371048 0.128952 0.128952 N\n0.621048 0.378952 0.378952 N\n0.621048 0.621048 0.378952 N\n0.621048 0.378952 0.621048 N\n0.375000 0.375000 0.875000 N\n0.378952 0.621048 0.378952 N\n0.378952 0.621048 0.621048 N\n0.378952 0.378952 0.621048 N\n0.371048 0.371048 0.128952 N\n0.875000 0.375000 0.375000 N\n",
"nsites": 24,
"nelements": 2,
"elements": [
"Cr",
"N"
],
"chemical_system": "Cr-N",
"density": 0.9743194975716172,
"density_atomic": 0.02200047180003538,
"volume": 1090.8856963677208,
"volume_molar": 27.372780069154317,
"formula_full": "Cr8 N16",
"formula_reduced": "CrN2",
"formula_anonymous": "AB2",
"energy_above_hull": 4.567294633333333,
"spacegroup": 227
},
{
"id": "jvasp-20520",
"created_at": "2022-09-04T14:37:34.535819Z",
"updated_at": "2022-09-04T14:37:34.535851Z",
"structure_string": "Er2 Ni4\n1.0\n4.351946 -0.000000 2.512597\n1.450649 4.103054 2.512597\n0.000000 0.000000 5.025194\nEr Ni\n2 4\ndirect\n0.125000 0.125000 0.125000 Er\n0.875001 0.874999 0.875000 Er\n0.500000 0.000000 0.500000 Ni\n0.000000 0.499999 0.500000 Ni\n0.500001 0.499999 0.500000 Ni\n0.500001 0.499999 0.000000 Ni\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Er",
"Ni"
],
"chemical_system": "Er-Ni",
"density": 10.535139970720826,
"density_atomic": 0.06686636077388954,
"volume": 89.73121806776905,
"volume_molar": 9.00623376283934,
"formula_full": "Er2 Ni4",
"formula_reduced": "ErNi2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.8395649333333333,
"spacegroup": 227
},
{
"id": "jvasp-35053",
"created_at": "2022-09-04T14:37:34.511600Z",
"updated_at": "2022-09-04T14:37:34.511614Z",
"structure_string": "Re2 N4\n1.0\n0.000000 2.923803 0.018250\n4.809242 0.000000 0.000000\n0.000000 -2.842355 -4.848076\nRe N\n2 4\ndirect\n0.120834 0.750549 0.990415 Re\n0.120834 0.249450 0.490414 Re\n0.916512 0.958565 0.204186 N\n0.916511 0.041434 0.704187 N\n0.492652 0.455342 0.294399 N\n0.492652 0.544658 0.794400 N\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Re",
"N"
],
"chemical_system": "N-Re",
"density": 10.474612942099805,
"density_atomic": 0.0883383565229666,
"volume": 67.92066590507707,
"volume_molar": 6.817130176555116,
"formula_full": "Re2 N4",
"formula_reduced": "ReN2",
"formula_anonymous": "AB2",
"energy_above_hull": 5.131794833333332,
"spacegroup": 102
},
{
"id": "jvasp-35051",
"created_at": "2022-09-04T14:37:34.501291Z",
"updated_at": "2022-09-04T14:37:34.501313Z",
"structure_string": "Re2 N4\n1.0\n0.000000 4.245625 -0.001364\n2.892710 0.000000 0.000000\n0.000000 -2.004436 -4.702449\nRe N\n2 4\ndirect\n0.293954 0.250000 0.283025 Re\n0.706043 0.750000 0.716975 Re\n0.655847 0.750000 0.295584 N\n0.344151 0.250000 0.704415 N\n0.889498 0.750000 0.170650 N\n0.110499 0.250000 0.829350 N\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Re",
"N"
],
"chemical_system": "N-Re",
"density": 12.317138542322754,
"density_atomic": 0.10387742076093918,
"volume": 57.760386771714764,
"volume_molar": 5.797352991521805,
"formula_full": "Re2 N4",
"formula_reduced": "ReN2",
"formula_anonymous": "AB2",
"energy_above_hull": 5.133574833333332,
"spacegroup": 11
},
{
"id": "jvasp-35904",
"created_at": "2022-09-04T14:37:34.472252Z",
"updated_at": "2022-09-04T14:37:34.472284Z",
"structure_string": "Ho2 Te4\n1.0\n4.438798 0.000000 0.000000\n0.000000 4.438798 0.000000\n0.000000 -0.000000 8.816307\nHo Te\n2 4\ndirect\n0.500000 0.000000 0.728950 Ho\n0.000000 0.500000 0.271051 Ho\n0.500000 0.000000 0.371513 Te\n0.000000 0.500000 0.628487 Te\n0.500000 0.500000 0.000000 Te\n0.000000 0.000000 0.000000 Te\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Ho",
"Te"
],
"chemical_system": "Ho-Te",
"density": 8.032405963959024,
"density_atomic": 0.03454091057256317,
"volume": 173.70705926803132,
"volume_molar": 17.434806031962456,
"formula_full": "Ho2 Te4",
"formula_reduced": "HoTe2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.5663170333333333,
"spacegroup": 129
},
{
"id": "jvasp-35767",
"created_at": "2022-09-04T14:37:34.724918Z",
"updated_at": "2022-09-04T14:37:34.724934Z",
"structure_string": "Pa1 C2\n1.0\n3.622386 0.000000 0.000000\n0.000000 3.622386 0.000000\n-1.811193 -1.811193 3.067031\nPa C\n1 2\ndirect\n0.000000 0.000000 0.000000 Pa\n0.610679 0.610679 0.221356 C\n0.389323 0.389323 0.778644 C\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Pa",
"C"
],
"chemical_system": "C-Pa",
"density": 10.523960331117276,
"density_atomic": 0.07454416179206426,
"volume": 40.24460035338905,
"volume_molar": 8.078621605268488,
"formula_full": "Pa1 C2",
"formula_reduced": "PaC2",
"formula_anonymous": "AB2",
"energy_above_hull": 4.857554366666667,
"spacegroup": 139
},
{
"id": "jvasp-41035",
"created_at": "2022-09-04T14:37:48.996586Z",
"updated_at": "2022-09-04T14:37:48.996602Z",
"structure_string": "Ho2 Cl4\n1.0\n6.810678 0.000000 0.000000\n0.000000 6.810678 0.000000\n0.000000 0.000000 3.435191\nHo Cl\n2 4\ndirect\n0.000000 0.000000 0.000000 Ho\n0.500000 0.500000 0.500000 Ho\n0.279381 0.279381 0.000000 Cl\n0.720619 0.720619 0.000000 Cl\n0.220619 0.779381 0.500000 Cl\n0.779381 0.220619 0.500000 Cl\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Ho",
"Cl"
],
"chemical_system": "Cl-Ho",
"density": 4.9153924442595205,
"density_atomic": 0.03765474105116739,
"volume": 159.34248470456512,
"volume_molar": 15.993047865650638,
"formula_full": "Ho2 Cl4",
"formula_reduced": "HoCl2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.0,
"spacegroup": 136
},
{
"id": "jvasp-35765",
"created_at": "2022-09-04T14:37:34.324907Z",
"updated_at": "2022-09-04T14:37:34.324936Z",
"structure_string": "Sc1 Ag2\n1.0\n3.552923 0.000000 0.000000\n0.000000 3.552923 -0.000000\n-1.776461 -1.776461 4.438956\nSc Ag\n1 2\ndirect\n0.000000 0.000000 0.000000 Sc\n0.665975 0.665975 0.331950 Ag\n0.334026 0.334026 0.668051 Ag\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Sc",
"Ag"
],
"chemical_system": "Ag-Sc",
"density": 7.725469638951425,
"density_atomic": 0.0535388235219029,
"volume": 56.03410390167969,
"volume_molar": 11.24817536854601,
"formula_full": "Sc1 Ag2",
"formula_reduced": "ScAg2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.4977599233333334,
"spacegroup": 139
},
{
"id": "jvasp-579",
"created_at": "2022-09-04T14:37:34.310375Z",
"updated_at": "2022-09-04T14:37:34.310402Z",
"structure_string": "Nb1 S2\n1.0\n-3.162864 0.001759 -0.005274\n-0.001809 -3.362035 0.007053\n1.571462 0.012558 5.654081\nNb S\n1 2\ndirect\n0.022191 0.171602 0.043423 Nb\n0.362333 0.171545 0.723453 S\n0.622171 0.671674 0.243375 S\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Nb",
"S"
],
"chemical_system": "Nb-S",
"density": 4.339139594899804,
"density_atomic": 0.04992010658958061,
"volume": 60.09602552864268,
"volume_molar": 12.06355749500132,
"formula_full": "Nb1 S2",
"formula_reduced": "NbS2",
"formula_anonymous": "AB2",
"energy_above_hull": 2.4590598000000004,
"spacegroup": 38
}
]
}