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=density_atomic&page=115",
"previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=density_atomic&page=113",
"results": [
{
"id": "mp-1096573",
"created_at": "2022-09-04T14:41:57.846751Z",
"structure_string": "Sc2 Zn1 Co1\n1.0\n-4.970080 5.627248 8.030064\n4.970080 -5.627248 8.030064\n4.970080 5.627248 -8.030064\nSc Zn Co\n2 1 1\ndirect\n0.000000 0.206643 0.206643 Sc\n0.000000 0.793357 0.793357 Sc\n0.000000 0.500000 0.500000 Zn\n0.000000 0.000000 0.000000 Co\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sc",
"Zn",
"Co"
],
"chemical_system": "Co-Sc-Zn",
"density": 0.39604053807680883,
"density_atomic": 0.004452680755153333,
"volume": 898.3352321790821,
"volume_molar": 135.24753044624285,
"formula_full": "Sc2 Zn1 Co1",
"formula_reduced": "Sc2ZnCo",
"formula_anonymous": "ABC2",
"energy": -12.54208586,
"energy_per_atom": -3.135521465,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -12.54208586,
"band_gap": 0.5234000000000001,
"is_gap_direct": true,
"is_magnetic": true,
"total_magnetization": 2.4527438,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:37.312000Z",
"spacegroup": 71
},
{
"id": "mp-1095816",
"created_at": "2022-09-04T14:41:48.694475Z",
"structure_string": "Mg2 Pt1 Au1\n1.0\n-4.983970 5.641576 7.978771\n4.983970 -5.641576 7.978771\n4.983970 5.641576 -7.978771\nMg Pt Au\n2 1 1\ndirect\n0.000000 0.242758 0.242758 Mg\n0.000000 0.757242 0.757242 Mg\n0.000000 0.000000 0.000000 Pt\n0.000000 0.500000 0.500000 Au\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Mg",
"Pt",
"Au"
],
"chemical_system": "Au-Mg-Pt",
"density": 0.815420140175158,
"density_atomic": 0.004457467002790279,
"volume": 897.3706361698439,
"volume_molar": 135.10230712263868,
"formula_full": "Mg2 Pt1 Au1",
"formula_reduced": "Mg2PtAu",
"formula_anonymous": "ABC2",
"energy": -8.29088351,
"energy_per_atom": -2.0727208775,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -8.29088351,
"band_gap": 0.2351999999999998,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 0.8744955,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:26.583000Z",
"spacegroup": 71
},
{
"id": "mp-1097569",
"created_at": "2022-09-04T14:39:09.868243Z",
"structure_string": "Zr2 Nb1 Pt1\n1.0\n-4.793933 5.746459 8.137670\n4.793933 -5.746459 8.137670\n4.793933 5.746459 -8.137670\nZr Nb Pt\n2 1 1\ndirect\n0.000000 0.245173 0.245173 Zr\n0.000000 0.754827 0.754827 Zr\n0.000000 0.000000 0.000000 Nb\n0.000000 0.500000 0.500000 Pt\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Zr",
"Nb",
"Pt"
],
"chemical_system": "Nb-Pt-Zr",
"density": 0.871163167152706,
"density_atomic": 0.004460747628060451,
"volume": 896.7106712870045,
"volume_molar": 135.0029470871108,
"formula_full": "Zr2 Nb1 Pt1",
"formula_reduced": "Zr2NbPt",
"formula_anonymous": "ABC2",
"energy": -20.78814922,
"energy_per_atom": -5.197037305,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -20.78814922,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 2.6456164,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:31.537000Z",
"spacegroup": 71
},
{
"id": "mp-1097431",
"created_at": "2022-09-04T14:45:13.632816Z",
"structure_string": "Sc1 Hg1 Pd2\n1.0\n-5.010527 5.623652 7.951937\n5.010527 -5.623652 7.951937\n5.010527 5.623652 -7.951937\nSc Hg Pd\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Sc\n0.000000 0.500000 0.500000 Hg\n0.000000 0.224721 0.224721 Pd\n0.000000 0.775279 0.775279 Pd\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sc",
"Hg",
"Pd"
],
"chemical_system": "Hg-Pd-Sc",
"density": 0.8492696267624201,
"density_atomic": 0.004462982917610602,
"volume": 896.2615528319175,
"volume_molar": 134.9353307232496,
"formula_full": "Sc1 Hg1 Pd2",
"formula_reduced": "ScHgPd2",
"formula_anonymous": "ABC2",
"energy": -12.80378934,
"energy_per_atom": -3.200947335,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -12.80378934,
"band_gap": 0.4365999999999999,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 3.33e-05,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:55.056000Z",
"spacegroup": 71
},
{
"id": "mp-1095898",
"created_at": "2022-09-04T14:40:13.976418Z",
"structure_string": "Sc2 Ge1 Pd1\n1.0\n-4.997997 5.621156 7.970599\n4.997997 -5.621156 7.970599\n4.997997 5.621156 -7.970599\nSc Ge Pd\n2 1 1\ndirect\n0.000000 0.249376 0.249376 Sc\n0.000000 0.750624 0.750624 Sc\n0.000000 0.000000 0.000000 Ge\n0.000000 0.500000 0.500000 Pd\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sc",
"Ge",
"Pd"
],
"chemical_system": "Ge-Pd-Sc",
"density": 0.49863562637724995,
"density_atomic": 0.00446567805709239,
"volume": 895.7206383579758,
"volume_molar": 134.85389414571964,
"formula_full": "Sc2 Ge1 Pd1",
"formula_reduced": "Sc2GePd",
"formula_anonymous": "ABC2",
"energy": -16.09454266,
"energy_per_atom": -4.023635665,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -16.09454266,
"band_gap": 0.8393999999999999,
"is_gap_direct": true,
"is_magnetic": false,
"total_magnetization": 4.1e-06,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:46.978000Z",
"spacegroup": 71
},
{
"id": "mp-1095900",
"created_at": "2022-09-04T14:48:16.749763Z",
"structure_string": "Zn1 Ag1 Au2\n1.0\n-5.086627 5.579415 7.889791\n5.086627 -5.579415 7.889791\n5.086627 5.579415 -7.889791\nZn Ag Au\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Zn\n0.000000 0.500000 0.500000 Ag\n0.000000 0.237905 0.237905 Au\n0.000000 0.762095 0.762095 Au\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Zn",
"Ag",
"Au"
],
"chemical_system": "Ag-Au-Zn",
"density": 1.0515966333511628,
"density_atomic": 0.0044659714583490644,
"volume": 895.6617921330558,
"volume_molar": 134.8450346394781,
"formula_full": "Zn1 Ag1 Au2",
"formula_reduced": "ZnAgAu2",
"formula_anonymous": "ABC2",
"energy": -6.68756487,
"energy_per_atom": -1.6718912175,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -6.68756487,
"band_gap": 1.6909999999999998,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 2.16e-05,
"is_theoretical": true,
"updated_at": "2021-11-28T01:38:49.849000Z",
"spacegroup": 71
},
{
"id": "mp-1093683",
"created_at": "2022-09-04T14:47:18.126470Z",
"structure_string": "Zn1 In1 Pd2\n1.0\n-5.004546 5.626837 7.949807\n5.004546 -5.626837 7.949807\n5.004546 5.626837 -7.949807\nZn In Pd\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Zn\n0.000000 0.500000 0.500000 In\n0.000000 0.245870 0.245870 Pd\n0.000000 0.754130 0.754130 Pd\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Zn",
"In",
"Pd"
],
"chemical_system": "In-Pd-Zn",
"density": 0.728903582759029,
"density_atomic": 0.004466983977143968,
"volume": 895.4587749735917,
"volume_molar": 134.81446969170335,
"formula_full": "Zn1 In1 Pd2",
"formula_reduced": "ZnInPd2",
"formula_anonymous": "ABC2",
"energy": -9.69857176,
"energy_per_atom": -2.42464294,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -9.69857176,
"band_gap": 0.1630999999999995,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.9999759,
"is_theoretical": true,
"updated_at": "2021-11-28T01:38:04.186000Z",
"spacegroup": 71
},
{
"id": "mp-1097454",
"created_at": "2022-09-04T14:46:34.239467Z",
"structure_string": "Sc1 Cd1 Pt2\n1.0\n-4.952810 5.651667 7.996022\n4.952810 -5.651667 7.996022\n4.952810 5.651667 -7.996022\nSc Cd Pt\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Sc\n0.000000 0.500000 0.500000 Cd\n0.000000 0.228676 0.228676 Pt\n0.000000 0.771324 0.771324 Pt\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sc",
"Cd",
"Pt"
],
"chemical_system": "Cd-Pt-Sc",
"density": 1.01554391634599,
"density_atomic": 0.00446784179804826,
"volume": 895.286847834981,
"volume_molar": 134.78858545597393,
"formula_full": "Sc1 Cd1 Pt2",
"formula_reduced": "ScCdPt2",
"formula_anonymous": "ABC2",
"energy": -14.94934729,
"energy_per_atom": -3.7373368225,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -14.94934729,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 7.76e-05,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:34.376000Z",
"spacegroup": 71
},
{
"id": "mp-1096180",
"created_at": "2022-09-04T14:43:20.218585Z",
"structure_string": "Li1 Zr1 Pd2\n1.0\n-4.981736 5.636816 7.966433\n4.981736 -5.636816 7.966433\n4.981736 5.636816 -7.966433\nLi Zr Pd\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Li\n0.000000 0.500000 0.500000 Zr\n0.000000 0.264639 0.264639 Pd\n0.000000 0.735361 0.735361 Pd\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Li",
"Zr",
"Pd"
],
"chemical_system": "Li-Pd-Zr",
"density": 0.577135782970445,
"density_atomic": 0.004470144112000671,
"volume": 894.8257371080032,
"volume_molar": 134.71916361337875,
"formula_full": "Li1 Zr1 Pd2",
"formula_reduced": "LiZrPd2",
"formula_anonymous": "ABC2",
"energy": -14.27820741,
"energy_per_atom": -3.5695518525,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -14.27820741,
"band_gap": 0.4173999999999997,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 1.0000555,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:12.465000Z",
"spacegroup": 71
},
{
"id": "mp-1096730",
"created_at": "2022-09-04T14:44:42.428668Z",
"structure_string": "Ti2 Nb1 Sn1\n1.0\n-4.883271 5.849626 7.831330\n4.883271 -5.849626 7.831330\n4.883271 5.849626 -7.831330\nTi Nb Sn\n2 1 1\ndirect\n0.000000 0.226720 0.226720 Ti\n0.000000 0.773280 0.773280 Ti\n0.000000 0.000000 0.000000 Nb\n0.000000 0.500000 0.500000 Sn\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ti",
"Nb",
"Sn"
],
"chemical_system": "Nb-Sn-Ti",
"density": 0.5703591449548521,
"density_atomic": 0.004470185533342566,
"volume": 894.817445532068,
"volume_molar": 134.71791528744365,
"formula_full": "Ti2 Nb1 Sn1",
"formula_reduced": "Ti2NbSn",
"formula_anonymous": "ABC2",
"energy": -17.40652733,
"energy_per_atom": -4.3516318325,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -17.40652733,
"band_gap": 0.2756000000000003,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 2.3236598,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:39.941000Z",
"spacegroup": 71
},
{
"id": "mp-1096028",
"created_at": "2022-09-04T14:42:14.945568Z",
"structure_string": "Mn1 Hg1 Pd2\n1.0\n-5.077772 5.580556 7.890713\n5.077772 -5.580556 7.890713\n5.077772 5.580556 -7.890713\nMn Hg Pd\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Mn\n0.000000 0.500000 0.500000 Hg\n0.000000 0.234577 0.234577 Pd\n0.000000 0.765423 0.765423 Pd\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Mn",
"Hg",
"Pd"
],
"chemical_system": "Hg-Mn-Pd",
"density": 0.869579811923485,
"density_atomic": 0.004472322215122302,
"volume": 894.3899405268174,
"volume_molar": 134.65355290451308,
"formula_full": "Mn1 Hg1 Pd2",
"formula_reduced": "MnHgPd2",
"formula_anonymous": "ABC2",
"energy": -13.64740011,
"energy_per_atom": -3.4118500275,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -13.64740011,
"band_gap": 0.3731999999999997,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 5.0001341,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:38.350000Z",
"spacegroup": 71
},
{
"id": "mp-1096490",
"created_at": "2022-09-04T14:39:35.147847Z",
"structure_string": "Mg1 Cd1 Pt2\n1.0\n-5.030175 5.612395 7.914749\n5.030175 -5.612395 7.914749\n5.030175 5.612395 -7.914749\nMg Cd Pt\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Mg\n0.000000 0.500000 0.500000 Cd\n0.000000 0.241817 0.241817 Pt\n0.000000 0.758183 0.758183 Pt\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Mg",
"Cd",
"Pt"
],
"chemical_system": "Cd-Mg-Pt",
"density": 0.9788939546464095,
"density_atomic": 0.0044753966231891144,
"volume": 893.7755324911623,
"volume_molar": 134.56105161264333,
"formula_full": "Mg1 Cd1 Pt2",
"formula_reduced": "MgCdPt2",
"formula_anonymous": "ABC2",
"energy": -8.27220515,
"energy_per_atom": -2.0680512875,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -8.27220515,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 0.7667941,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:35.803000Z",
"spacegroup": 71
}
]
}