HTTP 200 OK
Allow: GET, HEAD, OPTIONS
Content-Type: application/json
Vary: Accept
{
"count": 146323,
"next": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=-formula_full&page=10403",
"previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=-formula_full&page=10401",
"results": [
{
"id": "mp-1078924",
"created_at": "2022-09-04T14:48:31.593564Z",
"structure_string": "Ce2 Ni4 Sb4\n1.0\n4.493524 0.000000 0.000000\n0.000000 4.493524 0.000000\n0.000000 0.000000 9.824046\nCe Ni Sb\n2 4 4\ndirect\n0.000000 0.500000 0.239447 Ce\n0.500000 0.000000 0.760553 Ce\n0.000000 0.000000 0.000000 Ni\n0.500000 0.500000 0.000000 Ni\n0.000000 0.500000 0.619386 Ni\n0.500000 0.000000 0.380614 Ni\n0.000000 0.000000 0.500000 Sb\n0.500000 0.500000 0.500000 Sb\n0.000000 0.500000 0.873189 Sb\n0.500000 0.000000 0.126811 Sb\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Ce",
"Ni",
"Sb"
],
"chemical_system": "Ce-Ni-Sb",
"density": 8.388263496507157,
"density_atomic": 0.050412180369229585,
"volume": 198.36475880943578,
"volume_molar": 11.945804993738724,
"formula_full": "Ce2 Ni4 Sb4",
"formula_reduced": "Ce(NiSb)2",
"formula_anonymous": "AB2C2",
"energy": -58.52590614,
"energy_per_atom": -5.8525906139999995,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -57.75790614,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 1.3429985,
"is_theoretical": false,
"updated_at": "2021-11-28T01:39:54.580000Z",
"spacegroup": 129
},
{
"id": "mp-1196766",
"created_at": "2022-09-04T14:41:17.174264Z",
"structure_string": "Ce2 Ni4 N34 O48\n1.0\n10.257737 0.000000 0.000000\n0.000000 10.257737 0.000000\n0.000000 0.000000 10.257737\nCe Ni N O\n2 4 34 48\ndirect\n0.500000 0.500000 0.500000 Ce\n0.000000 0.000000 0.000000 Ce\n0.250000 0.750000 0.750000 Ni\n0.750000 0.750000 0.250000 Ni\n0.750000 0.250000 0.750000 Ni\n0.250000 0.250000 0.250000 Ni\n0.257274 0.548916 0.748098 N\n0.742726 0.548916 0.251902 N\n0.742726 0.451084 0.748098 N\n0.257274 0.451084 0.251902 N\n0.748098 0.257274 0.548916 N\n0.251902 0.742726 0.548916 N\n0.748098 0.742726 0.451084 N\n0.251902 0.257274 0.451084 N\n0.548916 0.748098 0.257274 N\n0.548916 0.251902 0.742726 N\n0.451084 0.748098 0.742726 N\n0.451084 0.251902 0.257274 N\n0.242726 0.951084 0.751902 N\n0.757274 0.951084 0.248098 N\n0.757274 0.048916 0.751902 N\n0.242726 0.048916 0.248098 N\n0.751902 0.242726 0.951084 N\n0.248098 0.757274 0.951084 N\n0.751902 0.757274 0.048916 N\n0.248098 0.242726 0.048916 N\n0.951084 0.751902 0.242726 N\n0.951084 0.248098 0.757274 N\n0.048916 0.751902 0.757274 N\n0.048916 0.248098 0.242726 N\n0.750000 0.250000 0.250000 N\n0.250000 0.250000 0.750000 N\n0.250000 0.750000 0.250000 N\n0.750000 0.750000 0.750000 N\n0.000000 0.500000 0.000000 N\n0.000000 0.000000 0.500000 N\n0.500000 0.000000 0.000000 N\n0.500000 0.000000 0.500000 N\n0.500000 0.500000 0.000000 N\n0.000000 0.500000 0.500000 N\n0.279458 0.493694 0.640223 O\n0.720542 0.493694 0.359777 O\n0.720542 0.506306 0.640223 O\n0.279458 0.506306 0.359777 O\n0.640223 0.279458 0.493694 O\n0.359777 0.720542 0.493694 O\n0.640223 0.720542 0.506306 O\n0.359777 0.279458 0.506306 O\n0.493694 0.640223 0.279458 O\n0.493694 0.359777 0.720542 O\n0.506306 0.640223 0.720542 O\n0.506306 0.359777 0.279458 O\n0.220542 0.006306 0.859777 O\n0.779458 0.006306 0.140223 O\n0.779458 0.993694 0.859777 O\n0.220542 0.993694 0.140223 O\n0.859777 0.220542 0.006306 O\n0.140223 0.779458 0.006306 O\n0.859777 0.779458 0.993694 O\n0.140223 0.220542 0.993694 O\n0.006306 0.859777 0.220542 O\n0.006306 0.140223 0.779458 O\n0.993694 0.859777 0.779458 O\n0.993694 0.140223 0.220542 O\n0.241240 0.487991 0.848811 O\n0.758760 0.487991 0.151189 O\n0.758760 0.512009 0.848811 O\n0.241240 0.512009 0.151189 O\n0.848811 0.241240 0.487991 O\n0.151189 0.758760 0.487991 O\n0.848811 0.758760 0.512009 O\n0.151189 0.241240 0.512009 O\n0.487991 0.848811 0.241240 O\n0.487991 0.151189 0.758760 O\n0.512009 0.848811 0.758760 O\n0.512009 0.151189 0.241240 O\n0.258760 0.012009 0.651189 O\n0.741240 0.012009 0.348811 O\n0.741240 0.987991 0.651189 O\n0.258760 0.987991 0.348811 O\n0.651189 0.258760 0.012009 O\n0.348811 0.741240 0.012009 O\n0.651189 0.741240 0.987991 O\n0.348811 0.258760 0.987991 O\n0.012009 0.651189 0.258760 O\n0.012009 0.348811 0.741240 O\n0.987991 0.651189 0.741240 O\n0.987991 0.348811 0.258760 O\n",
"nsites": 88,
"nelements": 4,
"elements": [
"Ce",
"Ni",
"N",
"O"
],
"chemical_system": "Ce-N-Ni-O",
"density": 2.7065170646388075,
"density_atomic": 0.08153198058737438,
"volume": 1079.3310718815928,
"volume_molar": 7.386231410809806,
"formula_full": "Ce2 Ni4 N34 O48",
"formula_reduced": "CeNi2N17O24",
"formula_anonymous": "AB2C17D24",
"energy": -561.80009104,
"energy_per_atom": -6.3840919436363635,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -518.66009104,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 29.9861088,
"is_theoretical": false,
"updated_at": "2021-11-28T01:35:26.978000Z",
"spacegroup": 201
},
{
"id": "mp-610645",
"created_at": "2022-09-04T14:41:52.466075Z",
"structure_string": "Ce2 Ni4 As4\n1.0\n4.143067 0.000000 0.000000\n0.000000 4.143067 0.000000\n0.000000 0.000000 9.129488\nCe Ni As\n2 4 4\ndirect\n0.500000 0.000000 0.252571 Ce\n0.000000 0.500000 0.747429 Ce\n0.500000 0.000000 0.882809 Ni\n0.500000 0.500000 0.500000 Ni\n0.000000 0.500000 0.117191 Ni\n0.000000 0.000000 0.500000 Ni\n0.000000 0.500000 0.370298 As\n0.500000 0.500000 0.000000 As\n0.000000 0.000000 0.000000 As\n0.500000 0.000000 0.629702 As\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Ce",
"Ni",
"As"
],
"chemical_system": "As-Ce-Ni",
"density": 8.63281062170496,
"density_atomic": 0.06381307381967213,
"volume": 156.70769955791135,
"volume_molar": 9.437158249135319,
"formula_full": "Ce2 Ni4 As4",
"formula_reduced": "Ce(NiAs)2",
"formula_anonymous": "AB2C2",
"energy": -61.71383967,
"energy_per_atom": -6.171383967,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -61.71383967,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.043861,
"is_theoretical": false,
"updated_at": "2021-11-28T01:35:30.226000Z",
"spacegroup": 129
},
{
"id": "mp-1654",
"created_at": "2022-09-04T14:47:24.397495Z",
"structure_string": "Ce2 Ni4\n1.0\n0.000000 3.587073 3.587073\n3.587073 0.000000 3.587073\n3.587073 3.587073 0.000000\nCe Ni\n2 4\ndirect\n0.500000 0.500000 0.500000 Ce\n0.750000 0.750000 0.750000 Ce\n0.125000 0.125000 0.125000 Ni\n0.625000 0.125000 0.125000 Ni\n0.125000 0.625000 0.125000 Ni\n0.125000 0.125000 0.625000 Ni\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Ce",
"Ni"
],
"chemical_system": "Ce-Ni",
"density": 9.264253028620365,
"density_atomic": 0.06499809220779913,
"volume": 92.31040167791353,
"volume_molar": 9.265103875275592,
"formula_full": "Ce2 Ni4",
"formula_reduced": "CeNi2",
"formula_anonymous": "AB2",
"energy": -37.2508372,
"energy_per_atom": -6.208472866666667,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -37.2508372,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0723391,
"is_theoretical": false,
"updated_at": "2021-11-28T01:38:10.402000Z",
"spacegroup": 227
},
{
"id": "mp-1025558",
"created_at": "2022-09-04T14:45:15.956267Z",
"structure_string": "Ce2 Ni2 Sn4\n1.0\n2.219393 -9.054003 0.000000\n2.219393 9.054003 0.000000\n0.000000 0.000000 4.547371\nCe Ni Sn\n2 2 4\ndirect\n0.609850 0.390150 0.250000 Ce\n0.390150 0.609850 0.750000 Ce\n0.818394 0.181606 0.250000 Ni\n0.181606 0.818394 0.750000 Ni\n0.953800 0.046200 0.250000 Sn\n0.046200 0.953800 0.750000 Sn\n0.249055 0.750945 0.250000 Sn\n0.750945 0.249055 0.750000 Sn\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Ce",
"Ni",
"Sn"
],
"chemical_system": "Ce-Ni-Sn",
"density": 7.927363915348869,
"density_atomic": 0.043774859163984305,
"volume": 182.75330070238095,
"volume_molar": 13.757076264804311,
"formula_full": "Ce2 Ni2 Sn4",
"formula_reduced": "CeNiSn2",
"formula_anonymous": "ABC2",
"energy": -43.72617396,
"energy_per_atom": -5.465771745,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -43.72617396,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 1.0423145,
"is_theoretical": false,
"updated_at": "2021-11-28T01:36:54.445000Z",
"spacegroup": 63
},
{
"id": "mp-542856",
"created_at": "2022-09-04T14:43:42.345593Z",
"structure_string": "Ce2 Ni2 Sn2 H4\n1.0\n2.184817 -3.784215 0.000000\n2.184817 3.784215 0.000000\n0.000000 0.000000 8.364009\nCe Ni Sn H\n2 2 2 4\ndirect\n0.000000 0.000000 0.500000 Ce\n0.000000 0.000000 0.000000 Ce\n0.666667 0.333333 0.750000 Ni\n0.333333 0.666667 0.250000 Ni\n0.333333 0.666667 0.750000 Sn\n0.666667 0.333333 0.250000 Sn\n0.333333 0.666667 0.443395 H\n0.666667 0.333333 0.556605 H\n0.333333 0.666667 0.056605 H\n0.666667 0.333333 0.943395 H\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Ce",
"Ni",
"Sn",
"H"
],
"chemical_system": "Ce-H-Ni-Sn",
"density": 7.67295325688614,
"density_atomic": 0.07230438619146708,
"volume": 138.30419600713157,
"volume_molar": 8.328873360535763,
"formula_full": "Ce2 Ni2 Sn2 H4",
"formula_reduced": "CeNiSnH2",
"formula_anonymous": "ABCD2",
"energy": -51.02924356,
"energy_per_atom": -5.102924356,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -50.31324356,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 0.0078459,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:14.233000Z",
"spacegroup": 194
},
{
"id": "mp-1077900",
"created_at": "2022-09-04T14:40:26.721576Z",
"structure_string": "Ce2 Ni2 Sn2\n1.0\n2.228576 -3.860007 0.000000\n2.228576 3.860007 0.000000\n0.000000 0.000000 7.762625\nCe Ni Sn\n2 2 2\ndirect\n0.000000 0.000000 0.500000 Ce\n0.000000 0.000000 0.000000 Ce\n0.333333 0.666667 0.250000 Ni\n0.666667 0.333333 0.750000 Ni\n0.333333 0.666667 0.750000 Sn\n0.666667 0.333333 0.250000 Sn\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ce",
"Ni",
"Sn"
],
"chemical_system": "Ce-Ni-Sn",
"density": 7.895783191834698,
"density_atomic": 0.04492593316323607,
"volume": 133.55315243423678,
"volume_molar": 13.404598048345177,
"formula_full": "Ce2 Ni2 Sn2",
"formula_reduced": "CeNiSn",
"formula_anonymous": "ABC",
"energy": -34.70184909,
"energy_per_atom": -5.783641515,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -34.70184909,
"band_gap": 0.081199999999999,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0155919,
"is_theoretical": false,
"updated_at": "2021-11-28T01:35:03.888000Z",
"spacegroup": 194
},
{
"id": "mp-1226819",
"created_at": "2022-09-04T14:48:30.668277Z",
"structure_string": "Ce2 Ni2 Sn2\n1.0\n-4.241355 0.000000 0.000000\n-2.120677 -3.772259 4.291553\n2.120677 3.479818 4.008113\nCe Ni Sn\n2 2 2\ndirect\n0.775981 0.662995 0.214958 Ce\n0.224019 0.337005 0.785042 Ce\n0.538949 0.311254 0.389152 Ni\n0.461051 0.688746 0.610848 Ni\n0.081300 0.089507 0.252106 Sn\n0.918700 0.910493 0.747894 Sn\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ce",
"Ni",
"Sn"
],
"chemical_system": "Ce-Ni-Sn",
"density": 8.27275574081133,
"density_atomic": 0.04707085572863944,
"volume": 127.46740859332635,
"volume_molar": 12.793777947690748,
"formula_full": "Ce2 Ni2 Sn2",
"formula_reduced": "CeNiSn",
"formula_anonymous": "ABC",
"energy": -34.61645241,
"energy_per_atom": -5.769408735,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -34.61645241,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 0.188198,
"is_theoretical": true,
"updated_at": "2021-11-28T01:39:59.355000Z",
"spacegroup": 12
},
{
"id": "mp-22713",
"created_at": "2022-09-04T14:39:21.705511Z",
"structure_string": "Ce2 Ni2 Sn1\n1.0\n-2.179614 2.905212 4.062053\n2.179614 -2.905212 4.062053\n2.179614 2.905212 -4.062053\nCe Ni Sn\n2 2 1\ndirect\n0.701854 0.201854 0.500000 Ce\n0.298146 0.798146 0.500000 Ce\n0.288363 0.500000 0.788363 Ni\n0.711637 0.500000 0.211637 Ni\n0.000000 0.000000 0.000000 Sn\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Ce",
"Ni",
"Sn"
],
"chemical_system": "Ce-Ni-Sn",
"density": 8.333212418363017,
"density_atomic": 0.04859672575276116,
"volume": 102.88759011127227,
"volume_molar": 12.392071002145313,
"formula_full": "Ce2 Ni2 Sn1",
"formula_reduced": "Ce2Ni2Sn",
"formula_anonymous": "AB2C2",
"energy": -29.95533015,
"energy_per_atom": -5.991066030000001,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -29.95533015,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 1.5139613,
"is_theoretical": false,
"updated_at": "2021-11-28T01:34:41.795000Z",
"spacegroup": 71
},
{
"id": "mp-22539",
"created_at": "2022-09-04T14:40:37.866388Z",
"structure_string": "Ce2 Ni2 Sb4\n1.0\n4.390703 0.000000 0.000000\n0.000000 4.390703 0.000000\n0.000000 0.000000 9.506769\nCe Ni Sb\n2 2 4\ndirect\n0.000000 0.500000 0.235178 Ce\n0.500000 0.000000 0.764822 Ce\n0.500000 0.500000 0.000000 Ni\n0.000000 0.000000 0.000000 Ni\n0.500000 0.000000 0.144217 Sb\n0.000000 0.500000 0.855783 Sb\n0.000000 0.000000 0.500000 Sb\n0.500000 0.500000 0.500000 Sb\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Ce",
"Ni",
"Sb"
],
"chemical_system": "Ce-Ni-Sb",
"density": 8.015374817215342,
"density_atomic": 0.043650469907820774,
"volume": 183.2740865538003,
"volume_molar": 13.796279336092608,
"formula_full": "Ce2 Ni2 Sb4",
"formula_reduced": "CeNiSb2",
"formula_anonymous": "ABC2",
"energy": -46.47356193,
"energy_per_atom": -5.80919524125,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -45.70556193,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0081093,
"is_theoretical": false,
"updated_at": "2021-11-28T01:35:07.943000Z",
"spacegroup": 129
},
{
"id": "mp-1205748",
"created_at": "2022-09-04T14:46:19.898496Z",
"structure_string": "Ce2 Ni2 Ge6\n1.0\n4.152862 0.000000 0.000000\n0.000000 0.000000 4.170156\n-2.076431 -10.909819 0.000000\nCe Ni Ge\n2 2 6\ndirect\n0.668423 0.500000 0.336846 Ce\n0.331577 0.500000 0.663154 Ce\n0.890427 0.000000 0.780853 Ni\n0.109573 0.000000 0.219147 Ni\n0.942726 0.500000 0.885452 Ge\n0.057274 0.500000 0.114548 Ge\n0.783534 0.000000 0.567068 Ge\n0.216466 0.000000 0.432932 Ge\n0.557159 0.000000 0.114317 Ge\n0.442841 0.000000 0.885683 Ge\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Ce",
"Ni",
"Ge"
],
"chemical_system": "Ce-Ge-Ni",
"density": 7.325139284795158,
"density_atomic": 0.052927655062117863,
"volume": 188.93714426349757,
"volume_molar": 11.37806077547209,
"formula_full": "Ce2 Ni2 Ge6",
"formula_reduced": "CeNiGe3",
"formula_anonymous": "ABC3",
"energy": -56.87227568,
"energy_per_atom": -5.687227568,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -56.87227568,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 0.5509713,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:25.734000Z",
"spacegroup": 65
},
{
"id": "mp-3541",
"created_at": "2022-09-04T14:40:07.058435Z",
"structure_string": "Ce2 Ni2 Ge4\n1.0\n2.111726 -8.305608 0.000000\n2.111726 8.305608 0.000000\n0.000000 0.000000 4.226052\nCe Ni Ge\n2 2 4\ndirect\n0.891779 0.108221 0.250000 Ce\n0.108221 0.891779 0.750000 Ce\n0.681349 0.318651 0.250000 Ni\n0.318651 0.681349 0.750000 Ni\n0.458120 0.541880 0.750000 Ge\n0.541880 0.458120 0.250000 Ge\n0.750238 0.249762 0.750000 Ge\n0.249762 0.750238 0.250000 Ge\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Ce",
"Ni",
"Ge"
],
"chemical_system": "Ce-Ge-Ni",
"density": 7.708618588528199,
"density_atomic": 0.053965494108579835,
"volume": 148.2428750472258,
"volume_molar": 11.159243252518568,
"formula_full": "Ce2 Ni2 Ge4",
"formula_reduced": "CeNiGe2",
"formula_anonymous": "ABC2",
"energy": -47.72738812,
"energy_per_atom": -5.965923515,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -47.72738812,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.062034,
"is_theoretical": false,
"updated_at": "2021-11-28T01:34:49.535000Z",
"spacegroup": 63
}
]
}