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=energy_per_atom&page=12152",
"previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=energy_per_atom&page=12150",
"results": [
{
"id": "mp-1093597",
"created_at": "2022-09-04T14:41:34.983805Z",
"structure_string": "In1 Hg2 Bi1\n1.0\n-5.809741 6.157974 8.655201\n5.809741 -6.157974 8.655201\n5.809741 6.157974 -8.655201\nIn Hg Bi\n1 2 1\ndirect\n0.000000 0.000000 0.000000 In\n0.000000 0.252080 0.252080 Hg\n0.000000 0.747920 0.747920 Hg\n0.000000 0.500000 0.500000 Bi\n",
"nsites": 4,
"nelements": 3,
"elements": [
"In",
"Hg",
"Bi"
],
"chemical_system": "Bi-Hg-In",
"density": 0.971946573007927,
"density_atomic": 0.003229447429537814,
"volume": 1238.601986028447,
"volume_molar": 186.47588763697155,
"formula_full": "In1 Hg2 Bi1",
"formula_reduced": "InHg2Bi",
"formula_anonymous": "ABC2",
"energy": -4.08924474,
"energy_per_atom": -1.022311185,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -4.08924474,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 1.1421154,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:25.476000Z",
"spacegroup": 71
},
{
"id": "mp-974799",
"created_at": "2022-09-04T14:39:30.522306Z",
"structure_string": "Rb3 Sr1\n1.0\n6.828638 0.000000 0.000000\n0.000000 6.828638 0.000000\n0.000000 0.000000 6.828638\nRb Sr\n3 1\ndirect\n0.500000 0.000000 0.000000 Rb\n0.000000 0.500000 0.000000 Rb\n0.000000 0.000000 0.500000 Rb\n0.500000 0.500000 0.500000 Sr\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Rb",
"Sr"
],
"chemical_system": "Rb-Sr",
"density": 1.794051103179012,
"density_atomic": 0.012561969072697889,
"volume": 318.42141760192493,
"volume_molar": 47.939464944938344,
"formula_full": "Rb3 Sr1",
"formula_reduced": "Rb3Sr",
"formula_anonymous": "AB3",
"energy": -4.08669524,
"energy_per_atom": -1.02167381,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -4.08669524,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.1196556,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:33.071000Z",
"spacegroup": 221
},
{
"id": "mp-1192978",
"created_at": "2022-09-04T14:40:01.097472Z",
"structure_string": "Cs2 K14 Rb10\n1.0\n4.394393 -7.611312 0.000000\n4.394393 7.611312 0.000000\n0.000000 0.000000 33.033930\nCs K Rb\n2 14 10\ndirect\n0.333333 0.666667 0.250000 Cs\n0.666667 0.333333 0.750000 Cs\n0.000000 0.000000 0.500000 K\n0.000000 0.000000 0.000000 K\n0.167130 0.832870 0.385041 K\n0.167130 0.334259 0.385041 K\n0.665741 0.832870 0.385041 K\n0.832870 0.167130 0.614959 K\n0.832870 0.665741 0.614959 K\n0.334259 0.167130 0.614959 K\n0.832870 0.167130 0.885041 K\n0.832870 0.665741 0.885041 K\n0.334259 0.167130 0.885041 K\n0.167130 0.832870 0.114959 K\n0.167130 0.334259 0.114959 K\n0.665741 0.832870 0.114959 K\n0.000000 0.000000 0.250000 Rb\n0.000000 0.000000 0.750000 Rb\n0.333333 0.666667 0.526512 Rb\n0.666667 0.333333 0.473488 Rb\n0.666667 0.333333 0.026512 Rb\n0.333333 0.666667 0.973488 Rb\n0.333333 0.666667 0.678820 Rb\n0.666667 0.333333 0.321180 Rb\n0.666667 0.333333 0.178820 Rb\n0.333333 0.666667 0.821180 Rb\n",
"nsites": 26,
"nelements": 3,
"elements": [
"Cs",
"K",
"Rb"
],
"chemical_system": "Cs-K-Rb",
"density": 1.2533182420129314,
"density_atomic": 0.011765887436167972,
"volume": 2209.7780674049973,
"volume_molar": 51.18305603951408,
"formula_full": "Cs2 K14 Rb10",
"formula_reduced": "CsK7Rb5",
"formula_anonymous": "AB5C7",
"energy": -26.554535090000005,
"energy_per_atom": -1.0213282726923079,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -26.554535090000005,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0506064,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:46.421000Z",
"spacegroup": 194
},
{
"id": "mp-1185558",
"created_at": "2022-09-04T14:45:38.718695Z",
"structure_string": "Cs2 K6\n1.0\n4.976089 -8.618839 0.000000\n4.976089 8.618839 0.000000\n0.000000 0.000000 7.821459\nCs K\n2 6\ndirect\n0.333333 0.666667 0.750000 Cs\n0.666667 0.333333 0.250000 Cs\n0.161379 0.322759 0.250000 K\n0.677241 0.838621 0.250000 K\n0.161379 0.838621 0.250000 K\n0.838621 0.677241 0.750000 K\n0.322759 0.161379 0.750000 K\n0.838621 0.161379 0.750000 K\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Cs",
"K"
],
"chemical_system": "Cs-K",
"density": 1.2385465475736732,
"density_atomic": 0.011924366361977549,
"volume": 670.8951869769013,
"volume_molar": 50.50281563976773,
"formula_full": "Cs2 K6",
"formula_reduced": "CsK3",
"formula_anonymous": "AB3",
"energy": -8.16141761,
"energy_per_atom": -1.02017720125,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -8.16141761,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.29237,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:04.813000Z",
"spacegroup": 194
},
{
"id": "mp-1186834",
"created_at": "2022-09-04T14:40:36.434804Z",
"structure_string": "Rb4 Mg2\n1.0\n-5.002542 5.002542 3.581331\n5.002542 -5.002542 3.581331\n5.002542 5.002542 -3.581331\nRb Mg\n4 2\ndirect\n0.665551 0.834449 0.500000 Rb\n0.334449 0.165551 0.500000 Rb\n0.165551 0.665551 0.831101 Rb\n0.834449 0.334449 0.168899 Rb\n0.750000 0.750000 0.000000 Mg\n0.250000 0.250000 0.000000 Mg\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Rb",
"Mg"
],
"chemical_system": "Mg-Rb",
"density": 1.8086864555467723,
"density_atomic": 0.016736525747880683,
"volume": 358.49734230294297,
"volume_molar": 35.982024290570415,
"formula_full": "Rb4 Mg2",
"formula_reduced": "Rb2Mg",
"formula_anonymous": "AB2",
"energy": -6.11146617,
"energy_per_atom": -1.018577695,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -6.11146617,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0032061,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:01.842000Z",
"spacegroup": 140
},
{
"id": "mp-1093830",
"created_at": "2022-09-04T14:44:28.848061Z",
"structure_string": "Sr2 Zn1 Sn1\n1.0\n-6.544605 6.613795 9.434321\n6.544605 -6.613795 9.434321\n6.544605 6.613795 -9.434321\nSr Zn Sn\n2 1 1\ndirect\n0.738682 0.000000 0.738682 Sr\n0.261318 0.000000 0.261318 Sr\n0.000000 0.000000 0.000000 Zn\n0.500000 0.000000 0.500000 Sn\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sr",
"Zn",
"Sn"
],
"chemical_system": "Sn-Sr-Zn",
"density": 0.36531946587831654,
"density_atomic": 0.002448810517223739,
"volume": 1633.446104492753,
"volume_molar": 245.92105912822566,
"formula_full": "Sr2 Zn1 Sn1",
"formula_reduced": "Sr2ZnSn",
"formula_anonymous": "ABC2",
"energy": -4.06755324,
"energy_per_atom": -1.01688831,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -4.06755324,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 1.999647,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:45.340000Z",
"spacegroup": 71
},
{
"id": "mp-974862",
"created_at": "2022-09-04T14:42:40.611037Z",
"structure_string": "Rb3 Na1\n1.0\n-3.279681 3.279681 6.919213\n3.279681 -3.279681 6.919213\n3.279681 3.279681 -6.919213\nRb Na\n3 1\ndirect\n0.750000 0.250000 0.500000 Rb\n0.250000 0.750000 0.500000 Rb\n0.500000 0.500000 0.000000 Rb\n0.000000 0.000000 0.000000 Na\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Rb",
"Na"
],
"chemical_system": "Na-Rb",
"density": 1.558421684154114,
"density_atomic": 0.013436312380636887,
"volume": 297.7007296856549,
"volume_molar": 44.819892463043104,
"formula_full": "Rb3 Na1",
"formula_reduced": "Rb3Na",
"formula_anonymous": "AB3",
"energy": -4.05770238,
"energy_per_atom": -1.014425595,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -4.05770238,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0019745,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:53.737000Z",
"spacegroup": 139
},
{
"id": "mp-30577",
"created_at": "2022-09-04T14:44:48.422933Z",
"structure_string": "Cs4 K8\n1.0\n4.533248 -7.851816 0.000000\n4.533248 7.851816 0.000000\n0.000000 0.000000 14.847829\nCs K\n4 8\ndirect\n0.333333 0.666667 0.437063 Cs\n0.666667 0.333333 0.937063 Cs\n0.666667 0.333333 0.562937 Cs\n0.333333 0.666667 0.062937 Cs\n0.167987 0.335975 0.750000 K\n0.832013 0.167987 0.250000 K\n0.335975 0.167987 0.250000 K\n0.664025 0.832013 0.750000 K\n0.000000 0.000000 0.000000 K\n0.000000 0.000000 0.500000 K\n0.832013 0.664025 0.250000 K\n0.167987 0.832013 0.750000 K\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Cs",
"K"
],
"chemical_system": "Cs-K",
"density": 1.326566415691028,
"density_atomic": 0.011352949363076454,
"volume": 1056.9940564544372,
"volume_molar": 53.04472492043339,
"formula_full": "Cs4 K8",
"formula_reduced": "CsK2",
"formula_anonymous": "AB2",
"energy": -12.16582409,
"energy_per_atom": -1.0138186741666666,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -12.16582409,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.1359226,
"is_theoretical": false,
"updated_at": "2021-11-28T01:36:46.514000Z",
"spacegroup": 194
},
{
"id": "mp-1097341",
"created_at": "2022-09-04T14:40:36.829506Z",
"structure_string": "La1 Cd2 Ag1\n1.0\n-5.942965 6.377883 8.961954\n5.942965 -6.377883 8.961954\n5.942965 6.377883 -8.961954\nLa Cd Ag\n1 2 1\ndirect\n0.000000 0.500000 0.500000 La\n0.000000 0.231785 0.231785 Cd\n0.000000 0.768215 0.768215 Cd\n0.000000 0.000000 0.000000 Ag\n",
"nsites": 4,
"nelements": 3,
"elements": [
"La",
"Cd",
"Ag"
],
"chemical_system": "Ag-Cd-La",
"density": 0.5763369767867764,
"density_atomic": 0.0029438628226609864,
"volume": 1358.758964313548,
"volume_molar": 204.56594355020007,
"formula_full": "La1 Cd2 Ag1",
"formula_reduced": "LaCd2Ag",
"formula_anonymous": "ABC2",
"energy": -4.0535213,
"energy_per_atom": -1.013380325,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -4.0535213,
"band_gap": 0.0950999999999999,
"is_gap_direct": true,
"is_magnetic": true,
"total_magnetization": 2.0,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:06.597000Z",
"spacegroup": 71
},
{
"id": "mp-1247841",
"created_at": "2022-09-04T14:42:17.093134Z",
"structure_string": "Ag7 P1 Se6\n1.0\n24.171598 2.679475 17.301880\n10.311375 23.984696 17.947361\n0.412701 0.987343 33.999971\nAg P Se\n7 1 6\ndirect\n0.270281 0.791274 0.270491 Ag\n0.540907 0.266101 0.266115 Ag\n0.369748 0.370207 0.890052 Ag\n0.541464 0.926404 0.266061 Ag\n0.805903 0.654339 0.269851 Ag\n0.926712 0.266498 0.540676 Ag\n0.911855 0.555138 0.266673 Ag\n0.750023 0.750247 0.749874 P\n0.311105 0.229750 0.229705 Se\n0.500020 0.500281 0.499904 Se\n0.394980 0.868361 0.868334 Se\n0.868426 0.868233 0.394642 Se\n0.868447 0.394406 0.868555 Se\n0.868329 0.867962 0.868666 Se\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Ag",
"P",
"Se"
],
"chemical_system": "Ag-P-Se",
"density": 0.11388907750999028,
"density_atomic": 0.0007621765129591865,
"volume": 18368.44846562424,
"volume_molar": 790.1241585913941,
"formula_full": "Ag7 P1 Se6",
"formula_reduced": "Ag7PSe6",
"formula_anonymous": "AB6C7",
"energy": -14.18568429,
"energy_per_atom": -1.0132631635714284,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -11.35368429,
"band_gap": 0.0606999999999997,
"is_gap_direct": true,
"is_magnetic": true,
"total_magnetization": 16.8224307,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:46.690000Z",
"spacegroup": 1
},
{
"id": "mp-973450",
"created_at": "2022-09-04T14:47:06.792392Z",
"structure_string": "Hg3 C1\n1.0\n4.282168 0.000000 0.000000\n0.000000 4.282168 0.000000\n0.000000 0.000000 4.282168\nHg C\n3 1\ndirect\n0.000000 0.500000 0.500000 Hg\n0.500000 0.000000 0.500000 Hg\n0.500000 0.500000 0.000000 Hg\n0.000000 0.000000 0.000000 C\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Hg",
"C"
],
"chemical_system": "C-Hg",
"density": 12.97989622939407,
"density_atomic": 0.05094116655712185,
"volume": 78.52195523466627,
"volume_molar": 11.821756679339478,
"formula_full": "Hg3 C1",
"formula_reduced": "Hg3C",
"formula_anonymous": "AB3",
"energy": -4.04793722,
"energy_per_atom": -1.011984305,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -4.04793722,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0107523,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:57.849000Z",
"spacegroup": 221
},
{
"id": "mp-1093549",
"created_at": "2022-09-04T14:47:12.013538Z",
"structure_string": "Ba1 Hg2 Sb1\n1.0\n-5.880127 7.010871 9.789373\n5.880127 -7.010871 9.789373\n5.880127 7.010871 -9.789373\nBa Hg Sb\n1 2 1\ndirect\n0.000000 0.500000 0.500000 Ba\n0.000000 0.228019 0.228019 Hg\n0.000000 0.771981 0.771981 Hg\n0.000000 0.000000 0.000000 Sb\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"Hg",
"Sb"
],
"chemical_system": "Ba-Hg-Sb",
"density": 0.6791960306576301,
"density_atomic": 0.0024779152080397866,
"volume": 1614.260240633615,
"volume_molar": 243.0325598091775,
"formula_full": "Ba1 Hg2 Sb1",
"formula_reduced": "BaHg2Sb",
"formula_anonymous": "ABC2",
"energy": -4.04515391,
"energy_per_atom": -1.0112884775,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -3.85315391,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0012678,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:59.673000Z",
"spacegroup": 71
}
]
}