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=1746",
"previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=density_atomic&page=1744",
"results": [
{
"id": "mp-542680",
"created_at": "2022-09-04T14:39:59.408646Z",
"structure_string": "Na12 In8 Au4\n1.0\n0.000000 6.828842 6.828842\n6.828842 0.000000 6.828842\n6.828842 6.828842 0.000000\nNa In Au\n12 8 4\ndirect\n0.451973 0.048027 0.048027 Na\n0.798027 0.201973 0.798027 Na\n0.451973 0.451973 0.048027 Na\n0.798027 0.798027 0.201973 Na\n0.201973 0.798027 0.798027 Na\n0.048027 0.451973 0.451973 Na\n0.048027 0.048027 0.451973 Na\n0.201973 0.201973 0.798027 Na\n0.451973 0.048027 0.451973 Na\n0.798027 0.201973 0.201973 Na\n0.048027 0.451973 0.048027 Na\n0.201973 0.798027 0.201973 Na\n0.415612 0.415612 0.415612 In\n0.753163 0.415612 0.415612 In\n0.834388 0.834388 0.834388 In\n0.415612 0.415612 0.753163 In\n0.834388 0.834388 0.496837 In\n0.415612 0.753163 0.415612 In\n0.834388 0.496837 0.834388 In\n0.496837 0.834388 0.834388 In\n0.625000 0.625000 0.125000 Au\n0.625000 0.125000 0.625000 Au\n0.125000 0.625000 0.625000 Au\n0.625000 0.625000 0.625000 Au\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Na",
"In",
"Au"
],
"chemical_system": "Au-In-Na",
"density": 5.168262364552492,
"density_atomic": 0.037682529912507534,
"volume": 636.899912392399,
"volume_molar": 15.981253843577896,
"formula_full": "Na12 In8 Au4",
"formula_reduced": "Na3In2Au",
"formula_anonymous": "AB2C3",
"energy": -56.66634107,
"energy_per_atom": -2.3610975445833335,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -56.66634107,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0007411,
"is_theoretical": false,
"updated_at": "2021-11-28T01:34:45.559000Z",
"spacegroup": 227
},
{
"id": "mp-1188363",
"created_at": "2022-09-04T14:46:20.336581Z",
"structure_string": "Na12 Ru4\n1.0\n0.000000 0.000000 4.794969\n9.410105 0.000000 0.000000\n0.000000 9.410105 0.000000\nNa Ru\n12 4\ndirect\n0.500000 0.967735 0.697813 Na\n0.500000 0.032265 0.302187 Na\n0.000000 0.532265 0.197813 Na\n0.000000 0.467735 0.802187 Na\n0.500000 0.697813 0.967735 Na\n0.500000 0.302187 0.032265 Na\n0.000000 0.197813 0.532265 Na\n0.000000 0.802187 0.467735 Na\n0.500000 0.377874 0.377874 Na\n0.500000 0.622126 0.622126 Na\n0.000000 0.122126 0.877874 Na\n0.000000 0.877874 0.122126 Na\n0.500000 0.291117 0.708883 Ru\n0.500000 0.708883 0.291117 Ru\n0.000000 0.208883 0.208883 Ru\n0.000000 0.791117 0.791117 Ru\n",
"nsites": 16,
"nelements": 2,
"elements": [
"Na",
"Ru"
],
"chemical_system": "Na-Ru",
"density": 2.6600124828869487,
"density_atomic": 0.03768298002226945,
"volume": 424.59486990000545,
"volume_molar": 15.98106295319825,
"formula_full": "Na12 Ru4",
"formula_reduced": "Na3Ru",
"formula_anonymous": "AB3",
"energy": -38.99497424,
"energy_per_atom": -2.43718589,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -38.99497424,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 5.8572709,
"is_theoretical": false,
"updated_at": "2021-11-28T01:37:34.405000Z",
"spacegroup": 136
},
{
"id": "mp-1227127",
"created_at": "2022-09-04T14:47:29.049123Z",
"structure_string": "Ca4 Mg4 Cd4\n1.0\n3.036416 -5.189912 0.000000\n3.036416 5.189912 0.000000\n0.000000 0.000000 10.103777\nCa Mg Cd\n4 4 4\ndirect\n0.667589 0.332411 0.313063 Ca\n0.334346 0.665654 0.194732 Ca\n0.334346 0.665654 0.805268 Ca\n0.667589 0.332411 0.686937 Ca\n0.164836 0.835164 0.500000 Mg\n0.336088 0.167731 0.000000 Mg\n0.832269 0.663912 0.000000 Mg\n0.831789 0.168211 0.000000 Mg\n0.001826 0.998174 0.247742 Cd\n0.001826 0.998174 0.752258 Cd\n0.658510 0.830958 0.500000 Cd\n0.169042 0.341490 0.500000 Cd\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Ca",
"Mg",
"Cd"
],
"chemical_system": "Ca-Cd-Mg",
"density": 3.687581244654083,
"density_atomic": 0.03768306615651639,
"volume": 318.4454245352029,
"volume_molar": 15.981026424407913,
"formula_full": "Ca4 Mg4 Cd4",
"formula_reduced": "CaMgCd",
"formula_anonymous": "ABC",
"energy": -20.98321163,
"energy_per_atom": -1.7486009691666666,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -20.98321163,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0007626,
"is_theoretical": true,
"updated_at": "2021-11-28T01:38:15.146000Z",
"spacegroup": 38
},
{
"id": "mp-1219337",
"created_at": "2022-09-04T14:46:59.396999Z",
"structure_string": "Sm4 Cu1 Sn8\n1.0\n0.000000 0.000000 4.428120\n4.468337 0.000000 0.000000\n0.000000 17.435157 0.000000\nSm Cu Sn\n4 1 8\ndirect\n0.250000 0.000000 0.095543 Sm\n0.250000 0.500000 0.605954 Sm\n0.750000 0.500000 0.395823 Sm\n0.750000 0.000000 0.897437 Sm\n0.250000 0.000000 0.318707 Cu\n0.250000 0.500000 0.236447 Sn\n0.250000 0.000000 0.747648 Sn\n0.750000 0.000000 0.236264 Sn\n0.750000 0.500000 0.755323 Sn\n0.250000 0.000000 0.463331 Sn\n0.250000 0.500000 0.936663 Sn\n0.750000 0.500000 0.053336 Sn\n0.750000 0.000000 0.574523 Sn\n",
"nsites": 13,
"nelements": 3,
"elements": [
"Sm",
"Cu",
"Sn"
],
"chemical_system": "Cu-Sm-Sn",
"density": 7.772140339137927,
"density_atomic": 0.03768358291338194,
"volume": 344.9778124835239,
"volume_molar": 15.980807275789742,
"formula_full": "Sm4 Cu1 Sn8",
"formula_reduced": "Sm4CuSn8",
"formula_anonymous": "AB4C8",
"energy": -62.56587438,
"energy_per_atom": -4.812759567692307,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -62.56587438,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0009576,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:48.230000Z",
"spacegroup": 25
},
{
"id": "mp-1206951",
"created_at": "2022-09-04T14:41:00.842692Z",
"structure_string": "Gd3 Mg3 Tl3\n1.0\n3.819016 -6.614729 0.000000\n3.819016 6.614729 0.000000\n0.000000 0.000000 4.727094\nGd Mg Tl\n3 3 3\ndirect\n0.570661 0.570661 0.000000 Gd\n0.429339 0.000000 0.000000 Gd\n0.000000 0.429339 0.000000 Gd\n0.243058 0.243058 0.500000 Mg\n0.756942 0.000000 0.500000 Mg\n0.000000 0.756942 0.500000 Mg\n0.666667 0.333333 0.500000 Tl\n0.333333 0.666667 0.500000 Tl\n0.000000 0.000000 0.000000 Tl\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Gd",
"Mg",
"Tl"
],
"chemical_system": "Gd-Mg-Tl",
"density": 8.050084951740946,
"density_atomic": 0.03768380442632541,
"volume": 238.82938936262815,
"volume_molar": 15.980713337406593,
"formula_full": "Gd3 Mg3 Tl3",
"formula_reduced": "GdMgTl",
"formula_anonymous": "ABC",
"energy": -57.18661314,
"energy_per_atom": -6.354068126666666,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -57.18661314,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 21.0095035,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:10.797000Z",
"spacegroup": 189
},
{
"id": "mp-571230",
"created_at": "2022-09-04T14:41:48.701111Z",
"structure_string": "Dy16 In4 Rh4\n1.0\n0.000000 6.828749 6.828749\n6.828749 0.000000 6.828749\n6.828749 6.828749 0.000000\nDy In Rh\n16 4 4\ndirect\n0.689091 0.310909 0.310909 Dy\n0.689091 0.689091 0.310909 Dy\n0.310909 0.689091 0.310909 Dy\n0.937933 0.937933 0.562067 Dy\n0.150189 0.150189 0.549432 Dy\n0.562067 0.937933 0.562067 Dy\n0.150189 0.150189 0.150189 Dy\n0.310909 0.310909 0.689091 Dy\n0.937933 0.562067 0.562067 Dy\n0.562067 0.562067 0.937933 Dy\n0.562067 0.937933 0.937933 Dy\n0.937933 0.562067 0.937933 Dy\n0.150189 0.549432 0.150189 Dy\n0.310909 0.689091 0.689091 Dy\n0.689091 0.310909 0.689091 Dy\n0.549432 0.150189 0.150189 Dy\n0.917267 0.917267 0.248199 In\n0.248199 0.917267 0.917267 In\n0.917267 0.248199 0.917267 In\n0.917267 0.917267 0.917267 In\n0.357497 0.357497 0.357497 Rh\n0.927510 0.357497 0.357497 Rh\n0.357497 0.357497 0.927510 Rh\n0.357497 0.927510 0.357497 Rh\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Dy",
"In",
"Rh"
],
"chemical_system": "Dy-In-Rh",
"density": 9.049758767117533,
"density_atomic": 0.037684069516471214,
"volume": 636.8738914864255,
"volume_molar": 15.980600920417583,
"formula_full": "Dy16 In4 Rh4",
"formula_reduced": "Dy4InRh",
"formula_anonymous": "ABC4",
"energy": -127.38579122,
"energy_per_atom": -5.307741300833333,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -127.38579122,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.2205404,
"is_theoretical": false,
"updated_at": "2021-11-28T01:35:40.128000Z",
"spacegroup": 216
},
{
"id": "mp-1184282",
"created_at": "2022-09-04T14:45:16.864274Z",
"structure_string": "Eu1 Mg5\n1.0\n2.991604 -5.181610 0.000000\n2.991604 5.181610 0.000000\n0.000000 0.000000 5.135509\nEu Mg\n1 5\ndirect\n0.000000 0.000000 0.500000 Eu\n0.000000 0.550136 0.000000 Mg\n0.333333 0.666667 0.500000 Mg\n0.550136 0.000000 0.000000 Mg\n0.666667 0.333333 0.500000 Mg\n0.449864 0.449864 0.000000 Mg\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Eu",
"Mg"
],
"chemical_system": "Eu-Mg",
"density": 2.85237514195367,
"density_atomic": 0.03768503583933421,
"volume": 159.21439017811488,
"volume_molar": 15.98019114450282,
"formula_full": "Eu1 Mg5",
"formula_reduced": "EuMg5",
"formula_anonymous": "AB5",
"energy": -18.48101808,
"energy_per_atom": -3.0801696799999996,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -18.48101808,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 7.1738823,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:54.543000Z",
"spacegroup": 189
},
{
"id": "mp-31166",
"created_at": "2022-09-04T14:45:16.870182Z",
"structure_string": "Dy1 Tl1 S2\n1.0\n7.621355 -2.016943 0.000000\n7.621355 2.016943 0.000000\n7.087584 0.000000 3.452429\nDy Tl S\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Dy\n0.500000 0.500000 0.500000 Tl\n0.732549 0.732549 0.732549 S\n0.267451 0.267451 0.267451 S\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Dy",
"Tl",
"S"
],
"chemical_system": "Dy-S-Tl",
"density": 6.743093801692972,
"density_atomic": 0.03768594616055868,
"volume": 106.1403628545836,
"volume_molar": 15.979805135694448,
"formula_full": "Dy1 Tl1 S2",
"formula_reduced": "DyTlS2",
"formula_anonymous": "ABC2",
"energy": -22.19200996,
"energy_per_atom": -5.54800249,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -21.18600996,
"band_gap": 1.5281999999999996,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0023597,
"is_theoretical": false,
"updated_at": "2021-11-28T01:36:57.590000Z",
"spacegroup": 166
},
{
"id": "mp-684609",
"created_at": "2022-09-04T14:41:21.275682Z",
"structure_string": "H1 Cl1\n1.0\n-2.125369 2.171904 2.874181\n2.125369 -2.171904 2.874181\n2.125369 2.171904 -2.874181\nH Cl\n1 1\ndirect\n0.313476 0.000000 0.313476 H\n0.018524 0.000000 0.018524 Cl\n",
"nsites": 2,
"nelements": 2,
"elements": [
"H",
"Cl"
],
"chemical_system": "Cl-H",
"density": 1.1408482645106668,
"density_atomic": 0.037686076316514015,
"volume": 53.06999813943489,
"volume_molar": 15.97974994643075,
"formula_full": "H1 Cl1",
"formula_reduced": "HCl",
"formula_anonymous": "AB",
"energy": -6.76555958,
"energy_per_atom": -3.38277979,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -6.15155958,
"band_gap": 5.1812000000000005,
"is_gap_direct": true,
"is_magnetic": false,
"total_magnetization": 0.0016265,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:28.506000Z",
"spacegroup": 44
},
{
"id": "mp-1080680",
"created_at": "2022-09-04T14:40:20.613037Z",
"structure_string": "Yb3 Cd3 Sn3\n1.0\n3.835090 -6.642570 0.000000\n3.835090 6.642570 0.000000\n0.000000 0.000000 4.687249\nYb Cd Sn\n3 3 3\ndirect\n0.000000 0.425432 0.500000 Yb\n0.574568 0.574568 0.500000 Yb\n0.425432 0.000000 0.500000 Yb\n0.000000 0.746992 0.000000 Cd\n0.253008 0.253008 0.000000 Cd\n0.746992 0.000000 0.000000 Cd\n0.333333 0.666667 0.000000 Sn\n0.666667 0.333333 0.000000 Sn\n0.000000 0.000000 0.500000 Sn\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Yb",
"Cd",
"Sn"
],
"chemical_system": "Cd-Sn-Yb",
"density": 8.430727165176988,
"density_atomic": 0.03768623819373737,
"volume": 238.81396582308932,
"volume_molar": 15.979681307116369,
"formula_full": "Yb3 Cd3 Sn3",
"formula_reduced": "YbCdSn",
"formula_anonymous": "ABC",
"energy": -24.12959934,
"energy_per_atom": -2.681066593333333,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -24.12959934,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0001286,
"is_theoretical": false,
"updated_at": "2021-11-28T01:34:49.181000Z",
"spacegroup": 189
},
{
"id": "mp-28313",
"created_at": "2022-09-04T14:39:06.270575Z",
"structure_string": "Nd4 Cl8\n1.0\n3.601588 0.000000 0.000000\n0.000000 8.762357 0.000000\n0.000000 0.000000 10.089425\nNd Cl\n4 8\ndirect\n0.250000 0.127637 0.178906 Nd\n0.750000 0.872363 0.821094 Nd\n0.250000 0.372363 0.678906 Nd\n0.750000 0.627637 0.321094 Nd\n0.250000 0.450110 0.161677 Cl\n0.750000 0.549890 0.838323 Cl\n0.250000 0.049890 0.661677 Cl\n0.750000 0.950110 0.338323 Cl\n0.250000 0.832982 0.046953 Cl\n0.750000 0.167018 0.953047 Cl\n0.250000 0.667018 0.546953 Cl\n0.750000 0.332982 0.453047 Cl\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Nd",
"Cl"
],
"chemical_system": "Cl-Nd",
"density": 4.488125698282933,
"density_atomic": 0.0376877192160375,
"volume": 318.40610813332427,
"volume_molar": 15.97905335018883,
"formula_full": "Nd4 Cl8",
"formula_reduced": "NdCl2",
"formula_anonymous": "AB2",
"energy": -61.63608056,
"energy_per_atom": -5.136340046666667,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -56.72408056,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 0.9366578,
"is_theoretical": false,
"updated_at": "2021-11-28T01:34:24.935000Z",
"spacegroup": 62
},
{
"id": "mp-1187185",
"created_at": "2022-09-04T14:48:16.765805Z",
"structure_string": "Sr1 Mg1 Hg2\n1.0\n0.000000 3.757877 3.757877\n3.757877 0.000000 3.757877\n3.757877 3.757877 0.000000\nSr Mg Hg\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Sr\n0.500000 0.500000 0.500000 Mg\n0.250000 0.250000 0.250000 Hg\n0.750000 0.750000 0.750000 Hg\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sr",
"Mg",
"Hg"
],
"chemical_system": "Hg-Mg-Sr",
"density": 8.027820727315781,
"density_atomic": 0.03768793243694612,
"volume": 106.13476891289298,
"volume_molar": 15.978962948087844,
"formula_full": "Sr1 Mg1 Hg2",
"formula_reduced": "SrMgHg2",
"formula_anonymous": "ABC2",
"energy": -5.45174335,
"energy_per_atom": -1.3629358375,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -5.45174335,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0026168,
"is_theoretical": true,
"updated_at": "2021-11-28T01:38:43.953000Z",
"spacegroup": 225
}
]
}