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=96",
"previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=density_atomic&page=94",
"results": [
{
"id": "mp-1096232",
"created_at": "2022-09-04T14:46:29.768749Z",
"structure_string": "Li1 Bi2 Pd1\n1.0\n-5.300897 5.777820 8.165287\n5.300897 -5.777820 8.165287\n5.300897 5.777820 -8.165287\nLi Bi Pd\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Li\n0.000000 0.262577 0.262577 Bi\n0.000000 0.737423 0.737423 Bi\n0.000000 0.500000 0.500000 Pd\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Li",
"Bi",
"Pd"
],
"chemical_system": "Bi-Li-Pd",
"density": 0.8819864509999313,
"density_atomic": 0.003998666388745918,
"volume": 1000.333514008029,
"volume_molar": 150.60373070754457,
"formula_full": "Li1 Bi2 Pd1",
"formula_reduced": "LiBi2Pd",
"formula_anonymous": "ABC2",
"energy": -10.14897711,
"energy_per_atom": -2.5372442775,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -10.14897711,
"band_gap": 0.2444999999999999,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 1.000043,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:40.603000Z",
"spacegroup": 71
},
{
"id": "mp-1095946",
"created_at": "2022-09-04T14:41:19.489468Z",
"structure_string": "Ag2 Hg1 Au1\n1.0\n-5.347192 5.751045 8.130341\n5.347192 -5.751045 8.130341\n5.347192 5.751045 -8.130341\nAg Hg Au\n2 1 1\ndirect\n0.000000 0.246712 0.246712 Ag\n0.000000 0.753288 0.753288 Ag\n0.000000 0.500000 0.500000 Hg\n0.000000 0.000000 0.000000 Au\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ag",
"Hg",
"Au"
],
"chemical_system": "Ag-Au-Hg",
"density": 1.0183001005818622,
"density_atomic": 0.0039996196621946535,
"volume": 1000.0950934932492,
"volume_molar": 150.56783566004268,
"formula_full": "Ag2 Hg1 Au1",
"formula_reduced": "Ag2HgAu",
"formula_anonymous": "ABC2",
"energy": -5.44299483,
"energy_per_atom": -1.3607487075,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -5.44299483,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 5.39e-05,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:19.117000Z",
"spacegroup": 71
},
{
"id": "mp-1097555",
"created_at": "2022-09-04T14:47:37.024632Z",
"structure_string": "Ta2 Co1 Os1\n1.0\n-4.513222 6.257872 8.848044\n4.513222 -6.257872 8.848044\n4.513222 6.257872 -8.848044\nTa Co Os\n2 1 1\ndirect\n0.000000 0.246108 0.246108 Ta\n0.000000 0.753892 0.753892 Ta\n0.000000 0.000000 0.000000 Co\n0.000000 0.500000 0.500000 Os\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ta",
"Co",
"Os"
],
"chemical_system": "Co-Os-Ta",
"density": 1.015106417276016,
"density_atomic": 0.004001652333744476,
"volume": 999.5870871313476,
"volume_molar": 150.491353514584,
"formula_full": "Ta2 Co1 Os1",
"formula_reduced": "Ta2CoOs",
"formula_anonymous": "ABC2",
"energy": -25.14792377,
"energy_per_atom": -6.2869809425,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -25.14792377,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 0.1236058,
"is_theoretical": true,
"updated_at": "2021-11-28T01:38:13.063000Z",
"spacegroup": 71
},
{
"id": "mp-1096461",
"created_at": "2022-09-04T14:44:04.674589Z",
"structure_string": "Hf1 Be1 Au2\n1.0\n-4.981903 6.029493 8.315145\n4.981903 -6.029493 8.315145\n4.981903 6.029493 -8.315145\nHf Be Au\n1 1 2\ndirect\n0.000000 0.500000 0.500000 Hf\n0.000000 0.000000 0.000000 Be\n0.000000 0.226255 0.226255 Au\n0.000000 0.773745 0.773745 Au\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Hf",
"Be",
"Au"
],
"chemical_system": "Au-Be-Hf",
"density": 0.9663726420144924,
"density_atomic": 0.004003631618963569,
"volume": 999.0929188024272,
"volume_molar": 150.41695473368668,
"formula_full": "Hf1 Be1 Au2",
"formula_reduced": "HfBeAu2",
"formula_anonymous": "ABC2",
"energy": -12.20287818,
"energy_per_atom": -3.050719545,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -12.20287818,
"band_gap": 0.1439000000000003,
"is_gap_direct": true,
"is_magnetic": true,
"total_magnetization": 2.0,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:32.455000Z",
"spacegroup": 71
},
{
"id": "mp-1097149",
"created_at": "2022-09-04T14:45:07.993997Z",
"structure_string": "Y1 Hf1 Pd2\n1.0\n-5.065779 5.935595 8.300010\n5.065779 -5.935595 8.300010\n5.065779 5.935595 -8.300010\nY Hf Pd\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Y\n0.000000 0.500000 0.500000 Hf\n0.000000 0.255568 0.255568 Pd\n0.000000 0.744432 0.744432 Pd\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Y",
"Hf",
"Pd"
],
"chemical_system": "Hf-Pd-Y",
"density": 0.798830371288454,
"density_atomic": 0.0040069219663001815,
"volume": 998.2724978528662,
"volume_molar": 150.29343747266896,
"formula_full": "Y1 Hf1 Pd2",
"formula_reduced": "YHfPd2",
"formula_anonymous": "ABC2",
"energy": -18.35812717,
"energy_per_atom": -4.5895317925,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -18.35812717,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 1.7991384,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:50.422000Z",
"spacegroup": 71
},
{
"id": "mp-1093560",
"created_at": "2022-09-04T14:41:19.592411Z",
"structure_string": "Li1 Y1 Pd2\n1.0\n-4.983735 5.951374 8.413792\n4.983735 -5.951374 8.413792\n4.983735 5.951374 -8.413792\nLi Y Pd\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Li\n0.000000 0.500000 0.500000 Y\n0.000000 0.259916 0.259916 Pd\n0.000000 0.740084 0.740084 Pd\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Li",
"Y",
"Pd"
],
"chemical_system": "Li-Pd-Y",
"density": 0.5135033471662008,
"density_atomic": 0.004007154096048694,
"volume": 998.2146690950196,
"volume_molar": 150.28473114967574,
"formula_full": "Li1 Y1 Pd2",
"formula_reduced": "LiYPd2",
"formula_anonymous": "ABC2",
"energy": -14.32883816,
"energy_per_atom": -3.58220954,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -14.32883816,
"band_gap": 1.1215000000000002,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0008215,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:15.818000Z",
"spacegroup": 71
},
{
"id": "mp-1095840",
"created_at": "2022-09-04T14:46:54.414606Z",
"structure_string": "Y2 Cu1 Pd1\n1.0\n-5.247631 5.789743 8.212342\n5.247631 -5.789743 8.212342\n5.247631 5.789743 -8.212342\nY Cu Pd\n2 1 1\ndirect\n0.000000 0.261026 0.261026 Y\n0.000000 0.738974 0.738974 Y\n0.000000 0.000000 0.000000 Cu\n0.000000 0.500000 0.500000 Pd\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Y",
"Cu",
"Pd"
],
"chemical_system": "Cu-Pd-Y",
"density": 0.5786303838865902,
"density_atomic": 0.004007840204799886,
"volume": 998.0437830853396,
"volume_molar": 150.25900365957054,
"formula_full": "Y2 Cu1 Pd1",
"formula_reduced": "Y2CuPd",
"formula_anonymous": "ABC2",
"energy": -14.63232064,
"energy_per_atom": -3.65808016,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -14.63232064,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 1.6359296,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:47.784000Z",
"spacegroup": 71
},
{
"id": "mp-1096709",
"created_at": "2022-09-04T14:42:06.021669Z",
"structure_string": "Cd2 Ag1 Pd1\n1.0\n-5.312973 5.763021 8.148505\n5.312973 -5.763021 8.148505\n5.312973 5.763021 -8.148505\nCd Ag Pd\n2 1 1\ndirect\n0.000000 0.245455 0.245455 Cd\n0.000000 0.754545 0.754545 Cd\n0.000000 0.500000 0.500000 Ag\n0.000000 0.000000 0.000000 Pd\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Cd",
"Ag",
"Pd"
],
"chemical_system": "Ag-Cd-Pd",
"density": 0.7306289629398811,
"density_atomic": 0.0040080603544871566,
"volume": 997.9889637943868,
"volume_molar": 150.25075042240852,
"formula_full": "Cd2 Ag1 Pd1",
"formula_reduced": "Cd2AgPd",
"formula_anonymous": "ABC2",
"energy": -5.6858983,
"energy_per_atom": -1.421474575,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -5.6858983,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0063906,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:47.213000Z",
"spacegroup": 71
},
{
"id": "mp-1093757",
"created_at": "2022-09-04T14:41:03.187510Z",
"structure_string": "Zr1 Ti1 Au2\n1.0\n-5.296046 5.846798 8.055105\n5.296046 -5.846798 8.055105\n5.296046 5.846798 -8.055105\nZr Ti Au\n1 1 2\ndirect\n0.000000 0.500000 0.500000 Zr\n0.000000 0.000000 0.000000 Ti\n0.000000 0.245980 0.245980 Au\n0.000000 0.754020 0.754020 Au\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Zr",
"Ti",
"Au"
],
"chemical_system": "Au-Ti-Zr",
"density": 0.8871456724631573,
"density_atomic": 0.004009211392257248,
"volume": 997.702442860699,
"volume_molar": 150.20761368757465,
"formula_full": "Zr1 Ti1 Au2",
"formula_reduced": "ZrTiAu2",
"formula_anonymous": "ABC2",
"energy": -13.86448933,
"energy_per_atom": -3.4661223325,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -13.86448933,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 3.4231925,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:09.170000Z",
"spacegroup": 71
},
{
"id": "mp-1097644",
"created_at": "2022-09-04T14:42:54.960648Z",
"structure_string": "Mn2 Mo1 Rh1\n1.0\n-5.217053 5.411584 8.832742\n5.217053 -5.411584 8.832742\n5.217053 5.411584 -8.832742\nMn Mo Rh\n2 1 1\ndirect\n0.000000 0.276444 0.276444 Mn\n0.000000 0.723556 0.723556 Mn\n0.000000 0.000000 0.000000 Mo\n0.000000 0.500000 0.500000 Rh\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Mn",
"Mo",
"Rh"
],
"chemical_system": "Mn-Mo-Rh",
"density": 0.5139382135056615,
"density_atomic": 0.00401009630035087,
"volume": 997.4822798270488,
"volume_molar": 150.1744673681049,
"formula_full": "Mn2 Mo1 Rh1",
"formula_reduced": "Mn2MoRh",
"formula_anonymous": "ABC2",
"energy": -22.53613712,
"energy_per_atom": -5.63403428,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -22.53613712,
"band_gap": 0.1095999999999999,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 14.9998057,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:53.011000Z",
"spacegroup": 71
},
{
"id": "mp-1096006",
"created_at": "2022-09-04T14:39:18.703682Z",
"structure_string": "Nb1 V1 Tc2\n1.0\n-4.542167 5.559498 9.872419\n4.542167 -5.559498 9.872419\n4.542167 5.559498 -9.872419\nNb V Tc\n1 1 2\ndirect\n0.000000 0.500000 0.500000 Nb\n0.000000 0.000000 0.000000 V\n0.000000 0.247392 0.247392 Tc\n0.000000 0.752608 0.752608 Tc\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Nb",
"V",
"Tc"
],
"chemical_system": "Nb-Tc-V",
"density": 0.5659152744723196,
"density_atomic": 0.004011231663159509,
"volume": 997.1999465244892,
"volume_molar": 150.1319610958737,
"formula_full": "Nb1 V1 Tc2",
"formula_reduced": "NbVTc2",
"formula_anonymous": "ABC2",
"energy": -24.69608186,
"energy_per_atom": -6.174020465,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -24.69608186,
"band_gap": 0.2063000000000001,
"is_gap_direct": true,
"is_magnetic": true,
"total_magnetization": 0.1515741,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:39.528000Z",
"spacegroup": 71
},
{
"id": "mp-1096503",
"created_at": "2022-09-04T14:45:14.640525Z",
"structure_string": "Mg2 Cu1 Ag1\n1.0\n-5.254831 5.791568 8.189744\n5.254831 -5.791568 8.189744\n5.254831 5.791568 -8.189744\nMg Cu Ag\n2 1 1\ndirect\n0.000000 0.247953 0.247953 Mg\n0.000000 0.752047 0.752047 Mg\n0.000000 0.000000 0.000000 Cu\n0.000000 0.500000 0.500000 Ag\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Mg",
"Cu",
"Ag"
],
"chemical_system": "Ag-Cu-Mg",
"density": 0.3664665309270116,
"density_atomic": 0.00401212781836547,
"volume": 996.9772103695315,
"volume_molar": 150.09842738393624,
"formula_full": "Mg2 Cu1 Ag1",
"formula_reduced": "Mg2CuAg",
"formula_anonymous": "ABC2",
"energy": -5.29900939,
"energy_per_atom": -1.3247523475,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -5.29900939,
"band_gap": 0.2080999999999999,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 4.61e-05,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:57.225000Z",
"spacegroup": 71
}
]
}