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{
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"next": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=total_magnetization&page=10154",
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"results": [
{
"id": "mp-777771",
"created_at": "2022-09-04T14:40:51.925815Z",
"structure_string": "Li6 Si4 Ni4 O16\n1.0\n10.449541 0.000000 -0.075882\n0.000000 5.026472 0.000000\n-0.043472 0.000000 6.561785\nLi Si Ni O\n6 4 4 16\ndirect\n0.161562 0.177645 0.116913 Li\n0.340427 0.689736 0.618766 Li\n0.417749 0.295896 0.366719 Li\n0.661562 0.322355 0.116913 Li\n0.840427 0.810264 0.618766 Li\n0.917749 0.204104 0.366719 Li\n0.088519 0.691808 0.369336 Si\n0.410247 0.177372 0.863811 Si\n0.588519 0.808192 0.369336 Si\n0.910247 0.322628 0.863811 Si\n0.160198 0.174086 0.631012 Ni\n0.338864 0.693777 0.105986 Ni\n0.660198 0.325914 0.631012 Ni\n0.838864 0.806223 0.105986 Ni\n0.062773 0.232324 0.855054 O\n0.095795 0.359101 0.391735 O\n0.164777 0.817596 0.571327 O\n0.163345 0.789478 0.168668 O\n0.332614 0.296844 0.656096 O\n0.347584 0.294646 0.075274 O\n0.396271 0.857311 0.856888 O\n0.439471 0.704281 0.367589 O\n0.562773 0.267676 0.855054 O\n0.595795 0.140899 0.391735 O\n0.664777 0.682404 0.571327 O\n0.663345 0.710522 0.168668 O\n0.832614 0.203156 0.656096 O\n0.847584 0.205354 0.075274 O\n0.896271 0.642689 0.856888 O\n0.939471 0.795719 0.367589 O\n",
"nsites": 30,
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"elements": [
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"Ni",
"O"
],
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"density": 3.1065633275170605,
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"volume": 344.636748520493,
"volume_molar": 6.9181700355304345,
"formula_full": "Li6 Si4 Ni4 O16",
"formula_reduced": "Li3Si2(NiO4)2",
"formula_anonymous": "A2B2C3D8",
"energy": -204.48752866,
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"energy_uncorrected": -183.33152866,
"band_gap": 0.9791999999999998,
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"is_magnetic": true,
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"is_theoretical": true,
"updated_at": "2021-11-28T01:35:21.942000Z",
"spacegroup": 7
},
{
"id": "mp-1188812",
"created_at": "2022-09-04T14:39:59.894574Z",
"structure_string": "La4 Mn2 Ni2 O12\n1.0\n-0.000002 -5.542530 -0.000016\n-5.544749 -0.000002 -0.005981\n-0.011107 -0.000022 -7.821376\nLa Mn Ni O\n4 2 2 12\ndirect\n0.468494 0.506068 0.750036 La\n0.031505 0.006064 0.250053 La\n0.531506 0.493932 0.249964 La\n0.968495 0.993936 0.749947 La\n0.500000 0.000000 0.500000 Mn\n0.000000 0.500000 0.000000 Mn\n0.000000 0.500000 0.500000 Ni\n0.500000 0.000000 0.000000 Ni\n0.290349 0.274107 0.460834 O\n0.209654 0.774111 0.960832 O\n0.709651 0.725893 0.539166 O\n0.790346 0.225889 0.039168 O\n0.723602 0.707672 0.960808 O\n0.776394 0.207669 0.460809 O\n0.276398 0.292328 0.039192 O\n0.223606 0.792331 0.539191 O\n0.513991 0.073395 0.741893 O\n0.986008 0.573395 0.241894 O\n0.486009 0.926605 0.258107 O\n0.013992 0.426605 0.758106 O\n",
"nsites": 20,
"nelements": 4,
"elements": [
"La",
"Mn",
"Ni",
"O"
],
"chemical_system": "La-Mn-Ni-O",
"density": 6.734831473996657,
"density_atomic": 0.08320655719938691,
"volume": 240.36567156689622,
"volume_molar": 7.237579540238895,
"formula_full": "La4 Mn2 Ni2 O12",
"formula_reduced": "La2MnNiO6",
"formula_anonymous": "ABC2D6",
"energy": -165.57397141,
"energy_per_atom": -8.278698570500001,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
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"energy_uncorrected": -148.91197141,
"band_gap": 0.0,
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"is_magnetic": true,
"total_magnetization": 9.9998687,
"is_theoretical": false,
"updated_at": "2021-11-28T01:34:56.050000Z",
"spacegroup": 14
},
{
"id": "mp-850531",
"created_at": "2022-09-04T14:45:11.474382Z",
"structure_string": "Mn3 Nb2 Co3 O16\n1.0\n2.886919 4.981866 0.000000\n-2.886919 4.981866 0.000000\n0.000000 0.163114 9.324520\nMn Nb Co O\n3 2 3 16\ndirect\n0.170306 0.170306 0.214756 Mn\n0.336036 0.836017 0.715648 Mn\n0.836017 0.336036 0.715648 Mn\n0.341821 0.341821 0.496837 Nb\n0.675322 0.675322 0.998955 Nb\n0.168104 0.666223 0.215106 Co\n0.666223 0.168104 0.215106 Co\n0.832840 0.832840 0.713240 Co\n0.162913 0.675354 0.599484 O\n0.482250 0.482250 0.329139 O\n0.340005 0.340005 0.112455 O\n0.996357 0.996357 0.309215 O\n0.000095 0.000095 0.813940 O\n0.675354 0.162913 0.599484 O\n0.035115 0.487254 0.330858 O\n0.487254 0.035115 0.330858 O\n0.838606 0.838606 0.102418 O\n0.167168 0.167168 0.597441 O\n0.517031 0.965995 0.831918 O\n0.965995 0.517031 0.831918 O\n0.668762 0.668762 0.608941 O\n0.330351 0.838529 0.099995 O\n0.517981 0.517981 0.832984 O\n0.838529 0.330351 0.099995 O\n",
"nsites": 24,
"nelements": 4,
"elements": [
"Mn",
"Nb",
"Co",
"O"
],
"chemical_system": "Co-Mn-Nb-O",
"density": 4.8501916678127275,
"density_atomic": 0.08948044197354925,
"volume": 268.21503638856063,
"volume_molar": 6.7301195961684765,
"formula_full": "Mn3 Nb2 Co3 O16",
"formula_reduced": "Mn3Nb2Co3O16",
"formula_anonymous": "A2B3C3D16",
"energy": -193.52242767,
"energy_per_atom": -8.063434486250001,
"energy_above_hull": null,
"is_stable": null,
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"band_gap": 0.0,
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"is_magnetic": true,
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"is_theoretical": true,
"updated_at": "2021-11-28T01:36:52.373000Z",
"spacegroup": 8
},
{
"id": "mp-1175111",
"created_at": "2022-09-04T14:44:59.420016Z",
"structure_string": "Li7 Mn2 Co3 O12\n1.0\n1.450597 7.632256 0.000000\n-1.450597 7.632256 0.000000\n0.000000 1.739005 9.754316\nLi Mn Co O\n7 2 3 12\ndirect\n0.077611 0.077611 0.269731 Li\n0.253145 0.253145 0.743909 Li\n0.414710 0.414710 0.258232 Li\n0.583773 0.583773 0.740618 Li\n0.747445 0.747445 0.256841 Li\n0.921332 0.921332 0.728658 Li\n0.500115 0.500115 0.502426 Li\n0.000163 0.000163 0.998103 Mn\n0.163031 0.163031 0.504111 Mn\n0.330936 0.330936 0.996728 Co\n0.670057 0.670057 0.006025 Co\n0.845927 0.845927 0.491949 Co\n0.120950 0.120950 0.894125 O\n0.286933 0.286933 0.391132 O\n0.466908 0.466908 0.885414 O\n0.630147 0.630147 0.390530 O\n0.789161 0.789161 0.884713 O\n0.950999 0.950999 0.375406 O\n0.051616 0.051616 0.616585 O\n0.203596 0.203596 0.124743 O\n0.369997 0.369997 0.616502 O\n0.535642 0.535642 0.109720 O\n0.705644 0.705644 0.610800 O\n0.880162 0.880162 0.103000 O\n",
"nsites": 24,
"nelements": 4,
"elements": [
"Li",
"Mn",
"Co",
"O"
],
"chemical_system": "Co-Li-Mn-O",
"density": 4.053625983973382,
"density_atomic": 0.11111807810731894,
"volume": 215.98645700855772,
"volume_molar": 5.419586859830097,
"formula_full": "Li7 Mn2 Co3 O12",
"formula_reduced": "Li7Mn2(CoO4)3",
"formula_anonymous": "A2B3C7D12",
"energy": -157.00016939,
"energy_per_atom": -6.541673724583333,
"energy_above_hull": null,
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"energy_uncorrected": -140.50616939,
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"updated_at": "2021-11-28T01:36:51.929000Z",
"spacegroup": 8
},
{
"id": "mp-14928",
"created_at": "2022-09-04T14:45:09.565348Z",
"structure_string": "Sc4 Mn2 Se8\n1.0\n0.000000 5.575356 5.575356\n5.575356 0.000000 5.575356\n5.575356 5.575356 0.000000\nSc Mn Se\n4 2 8\ndirect\n0.125000 0.125000 0.125000 Sc\n0.625000 0.125000 0.125000 Sc\n0.125000 0.625000 0.125000 Sc\n0.125000 0.125000 0.625000 Sc\n0.500000 0.500000 0.500000 Mn\n0.750000 0.750000 0.750000 Mn\n0.369113 0.892661 0.369113 Se\n0.880887 0.880887 0.357339 Se\n0.357339 0.880887 0.880887 Se\n0.880887 0.880887 0.880887 Se\n0.892661 0.369113 0.369113 Se\n0.369113 0.369113 0.369113 Se\n0.369113 0.369113 0.892661 Se\n0.880887 0.357339 0.880887 Se\n",
"nsites": 14,
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"elements": [
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"Mn",
"Se"
],
"chemical_system": "Mn-Sc-Se",
"density": 4.414077451173299,
"density_atomic": 0.04039059305205975,
"volume": 346.61536120440945,
"volume_molar": 14.909760676794262,
"formula_full": "Sc4 Mn2 Se8",
"formula_reduced": "Sc2MnSe4",
"formula_anonymous": "AB2C4",
"energy": -94.19667239,
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"energy_above_hull": null,
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"energy_uncorrected": -90.42067239,
"band_gap": 0.0,
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"is_magnetic": true,
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"updated_at": "2021-11-28T01:36:53.980000Z",
"spacegroup": 227
},
{
"id": "mp-1181788",
"created_at": "2022-09-04T14:43:06.760403Z",
"structure_string": "Fe4 S4 O32\n1.0\n8.490000 -0.609603 -0.024434\n-2.228989 12.126473 -1.146542\n0.015275 -0.011447 6.454333\nFe S O\n4 4 32\ndirect\n0.099387 0.070824 0.844463 Fe\n0.900613 0.929176 0.155537 Fe\n0.098487 0.728075 0.732564 Fe\n0.901513 0.271925 0.267436 Fe\n0.180285 0.356308 0.937983 S\n0.819715 0.643692 0.062017 S\n0.778257 0.066965 0.556012 S\n0.221743 0.933035 0.443988 S\n0.994235 0.648814 0.977449 O\n0.005765 0.351186 0.022551 O\n0.702451 0.584637 0.899862 O\n0.297549 0.415363 0.100138 O\n0.201092 0.241727 0.875393 O\n0.798908 0.758273 0.124607 O\n0.181544 0.412529 0.747895 O\n0.818456 0.587471 0.252105 O\n0.188921 0.031471 0.577291 O\n0.811079 0.968529 0.422709 O\n0.247449 0.844164 0.580521 O\n0.752551 0.155836 0.419479 O\n0.631235 0.032056 0.668176 O\n0.368765 0.967944 0.331824 O\n0.925376 0.119612 0.690481 O\n0.074624 0.880388 0.309519 O\n0.946456 0.920732 0.871309 O\n0.053544 0.079268 0.128691 O\n0.505981 0.289653 0.543774 O\n0.494019 0.710347 0.456226 O\n0.155619 0.619063 0.615421 O\n0.844381 0.380937 0.384579 O\n0.204853 0.797962 0.948871 O\n0.795147 0.202038 0.051129 O\n0.648777 0.331371 0.631525 O\n0.351223 0.668629 0.368475 O\n0.255957 0.034923 0.980009 O\n0.744043 0.965077 0.019991 O\n0.506335 0.737259 0.650705 O\n0.493665 0.262741 0.349295 O\n0.931729 0.752247 0.648715 O\n0.068271 0.247753 0.351285 O\n",
"nsites": 40,
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"elements": [
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"S",
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],
"chemical_system": "Fe-O-S",
"density": 2.1873224895718493,
"density_atomic": 0.061009942902104236,
"volume": 655.6308381436036,
"volume_molar": 9.870752984743895,
"formula_full": "Fe4 S4 O32",
"formula_reduced": "FeSO8",
"formula_anonymous": "ABC8",
"energy": -219.66519197,
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"updated_at": "2021-11-28T01:35:56.697000Z",
"spacegroup": 2
},
{
"id": "mp-850462",
"created_at": "2022-09-04T14:44:59.775835Z",
"structure_string": "Li4 Mn1 V3 P8 O28\n1.0\n7.165181 0.000000 0.000000\n-0.054583 8.297521 0.000000\n-3.520714 -0.076239 9.088444\nLi Mn V P O\n4 1 3 8 28\ndirect\n0.325378 0.360905 0.751676 Li\n0.674518 0.861660 0.748601 Li\n0.324779 0.360458 0.250739 Li\n0.674459 0.862214 0.250298 Li\n0.268156 0.999071 0.241705 Mn\n0.271606 0.999711 0.743473 V\n0.728000 0.499680 0.755957 V\n0.727297 0.499457 0.256716 V\n0.086763 0.784314 0.936924 P\n0.478029 0.680869 0.939065 P\n0.521692 0.178857 0.560342 P\n0.087950 0.783068 0.436326 P\n0.914140 0.283925 0.563333 P\n0.481877 0.680193 0.440159 P\n0.522712 0.178941 0.061013 P\n0.913196 0.287715 0.062105 P\n0.246482 0.653659 0.921285 O\n0.085267 0.933476 0.844644 O\n0.395583 0.176458 0.895805 O\n0.493928 0.843716 0.870762 O\n0.516586 0.538865 0.851621 O\n0.846040 0.326774 0.899048 O\n0.885926 0.696572 0.876048 O\n0.113752 0.196614 0.623666 O\n0.148914 0.824752 0.599173 O\n0.481661 0.038155 0.647521 O\n0.506280 0.342300 0.628888 O\n0.604800 0.674676 0.605961 O\n0.916918 0.433441 0.657970 O\n0.752155 0.152431 0.578189 O\n0.249103 0.654574 0.420949 O\n0.084915 0.933653 0.343016 O\n0.391943 0.176327 0.395004 O\n0.505481 0.841999 0.375846 O\n0.517821 0.536126 0.352962 O\n0.851447 0.324406 0.400807 O\n0.887324 0.695000 0.377631 O\n0.114611 0.204815 0.119890 O\n0.144497 0.824217 0.101037 O\n0.481276 0.036075 0.146421 O\n0.505889 0.342228 0.129024 O\n0.604805 0.678012 0.104005 O\n0.912832 0.436886 0.156509 O\n0.753214 0.153914 0.077882 O\n",
"nsites": 44,
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"elements": [
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"Mn",
"V",
"P",
"O"
],
"chemical_system": "Li-Mn-O-P-V",
"density": 2.8620259346212795,
"density_atomic": 0.08143059630273358,
"volume": 540.337440689022,
"volume_molar": 7.395427558471458,
"formula_full": "Li4 Mn1 V3 P8 O28",
"formula_reduced": "Li4MnV3(P2O7)4",
"formula_anonymous": "AB3C4D8E28",
"energy": -344.36264217,
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"energy_above_hull": null,
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"updated_at": "2021-11-28T01:36:47.689000Z",
"spacegroup": 1
},
{
"id": "mp-765807",
"created_at": "2022-09-04T14:43:59.378293Z",
"structure_string": "Li4 V5 O9 F1\n1.0\n1.505437 5.004531 0.000000\n-1.505437 5.004531 0.000000\n0.000000 2.593905 12.868951\nLi V O F\n4 5 9 1\ndirect\n0.798550 0.798550 0.398549 Li\n0.603785 0.603785 0.799810 Li\n0.200065 0.200065 0.597041 Li\n0.396543 0.396543 0.194133 Li\n0.901174 0.901174 0.698643 V\n0.686030 0.686030 0.105013 V\n0.321560 0.321560 0.898210 V\n0.497963 0.497963 0.500740 V\n0.095340 0.095340 0.303996 V\n0.858013 0.858013 0.552719 O\n0.947320 0.947320 0.844124 O\n0.539915 0.539915 0.648612 O\n0.733396 0.733396 0.251289 O\n0.455646 0.455646 0.355593 O\n0.263973 0.263973 0.755342 O\n0.310894 0.310894 0.049395 O\n0.051209 0.051209 0.160109 O\n0.137407 0.137407 0.451340 O\n0.667493 0.667493 0.940824 F\n",
"nsites": 19,
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"elements": [
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"V",
"O",
"F"
],
"chemical_system": "F-Li-O-V",
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"volume": 193.90951157123843,
"volume_molar": 6.146054596762351,
"formula_full": "Li4 V5 O9 F1",
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"formula_anonymous": "AB4C5D9",
"energy": -147.24153567000002,
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"spacegroup": 8
},
{
"id": "mp-803159",
"created_at": "2022-09-04T14:47:26.957454Z",
"structure_string": "Li4 Mn2 V2 P6 O24\n1.0\n8.223876 0.000000 0.000000\n-3.989223 7.410670 0.000000\n-0.045852 -4.696145 7.541551\nLi Mn V P O\n4 2 2 6 24\ndirect\n0.915295 0.873507 0.858807 Li\n0.671763 0.199896 0.867818 Li\n0.328237 0.800104 0.132182 Li\n0.084705 0.126493 0.141193 Li\n0.649333 0.405582 0.948748 Mn\n0.350667 0.594418 0.051252 Mn\n0.144405 0.410669 0.436445 V\n0.855595 0.589331 0.563555 V\n0.246757 0.285789 0.745181 P\n0.961510 0.700693 0.753928 P\n0.534838 0.997525 0.751381 P\n0.465162 0.002475 0.248619 P\n0.038490 0.299307 0.246072 P\n0.753243 0.714211 0.254819 P\n0.205262 0.930432 0.908610 O\n0.097452 0.405879 0.711873 O\n0.454251 0.364311 0.794785 O\n0.818450 0.704138 0.791138 O\n0.142314 0.532866 0.912476 O\n0.512820 0.899066 0.891934 O\n0.194655 0.409435 0.578731 O\n0.859405 0.530995 0.725320 O\n0.008428 0.028420 0.583901 O\n0.512549 0.738943 0.802293 O\n0.737693 0.157579 0.730335 O\n0.381457 0.232603 0.572387 O\n0.618543 0.767397 0.427613 O\n0.262307 0.842421 0.269665 O\n0.487451 0.261057 0.197707 O\n0.991572 0.971580 0.416099 O\n0.140595 0.469005 0.274680 O\n0.805345 0.590565 0.421269 O\n0.487180 0.100934 0.108066 O\n0.857686 0.467134 0.087524 O\n0.181550 0.295862 0.208862 O\n0.545749 0.635689 0.205215 O\n0.902548 0.594121 0.288127 O\n0.794738 0.069568 0.091390 O\n",
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"elements": [
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],
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"formula_full": "Li4 Mn2 V2 P6 O24",
"formula_reduced": "Li2MnV(PO4)3",
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"energy_above_hull": null,
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"energy_uncorrected": -78.7003245,
"band_gap": 0.0,
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"updated_at": "2021-11-28T01:38:14.954000Z",
"spacegroup": 2
},
{
"id": "mp-1177635",
"created_at": "2022-09-04T14:42:03.920122Z",
"structure_string": "Li3 Mn2 Sb1 O6\n1.0\n1.569162 6.641307 0.000000\n-1.569162 6.641307 0.000000\n0.000000 1.331283 6.213128\nLi Mn Sb O\n3 2 1 6\ndirect\n0.500000 0.500000 0.500000 Li\n0.164613 0.164613 0.198071 Li\n0.835387 0.835387 0.801929 Li\n0.173940 0.173940 0.651199 Mn\n0.826060 0.826060 0.348801 Mn\n0.500000 0.500000 0.000000 Sb\n0.650537 0.650537 0.919090 O\n0.339728 0.339728 0.578997 O\n0.349463 0.349463 0.080910 O\n0.003930 0.003930 0.214594 O\n0.996070 0.996070 0.785406 O\n0.660272 0.660272 0.421003 O\n",
"nsites": 12,
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"elements": [
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"Sb",
"O"
],
"chemical_system": "Li-Mn-O-Sb",
"density": 4.4682223191377375,
"density_atomic": 0.09266582803601121,
"volume": 129.4975748270078,
"volume_molar": 6.498771864057281,
"formula_full": "Li3 Mn2 Sb1 O6",
"formula_reduced": "Li3Mn2SbO6",
"formula_anonymous": "AB2C3D6",
"energy": -82.35195049,
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"energy_uncorrected": -74.89395049,
"band_gap": 0.2923,
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"is_magnetic": true,
"total_magnetization": 9.999872,
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"updated_at": "2021-11-28T01:35:32.937000Z",
"spacegroup": 12
},
{
"id": "mp-758690",
"created_at": "2022-09-04T14:41:00.630416Z",
"structure_string": "Li4 Mn2 Ni3 O10\n1.0\n5.042465 0.000000 0.000000\n-0.969931 5.001562 0.000000\n-2.474007 -2.033034 6.955619\nLi Mn Ni O\n4 2 3 10\ndirect\n0.083300 0.769431 0.590436 Li\n0.699201 0.604797 0.219322 Li\n0.300799 0.395203 0.780678 Li\n0.916700 0.230569 0.409564 Li\n0.301730 0.901502 0.307977 Mn\n0.698270 0.098498 0.692023 Mn\n0.500000 0.000000 0.000000 Ni\n0.893410 0.696148 0.896813 Ni\n0.106590 0.303852 0.103187 Ni\n0.918737 0.947205 0.151274 O\n0.684602 0.887111 0.454252 O\n0.299120 0.678600 0.060330 O\n0.518764 0.782297 0.772030 O\n0.099916 0.567086 0.331250 O\n0.900084 0.432914 0.668750 O\n0.481236 0.217703 0.227970 O\n0.700880 0.321400 0.939670 O\n0.315398 0.112889 0.545748 O\n0.081263 0.052795 0.848726 O\n",
"nsites": 19,
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"elements": [
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"Ni",
"O"
],
"chemical_system": "Li-Mn-Ni-O",
"density": 4.484161534538232,
"density_atomic": 0.10831017727100432,
"volume": 175.42211155706863,
"volume_molar": 5.560087622174159,
"formula_full": "Li4 Mn2 Ni3 O10",
"formula_reduced": "Li4Mn2Ni3O10",
"formula_anonymous": "A2B3C4D10",
"energy": -125.15316553,
"energy_per_atom": -6.587008712105263,
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"band_gap": 0.0,
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"updated_at": "2021-11-28T01:35:11.319000Z",
"spacegroup": 2
},
{
"id": "mp-704950",
"created_at": "2022-09-04T14:39:38.289701Z",
"structure_string": "Sr2 Fe2 Sn2 P6 O24\n1.0\n8.126314 -4.299891 0.000000\n8.126314 4.299891 0.000000\n5.851106 0.000000 7.091587\nSr Fe Sn P O\n2 2 2 6 24\ndirect\n0.000000 0.000000 0.000000 Sr\n0.500000 0.500000 0.500000 Sr\n0.848420 0.848420 0.848420 Fe\n0.151580 0.151580 0.151580 Fe\n0.649372 0.649372 0.649372 Sn\n0.350628 0.350628 0.350628 Sn\n0.754562 0.459364 0.039459 P\n0.540636 0.960541 0.245438 P\n0.459364 0.039459 0.754562 P\n0.960541 0.245438 0.540636 P\n0.245438 0.540636 0.960541 P\n0.039459 0.754562 0.459364 P\n0.406426 0.593445 0.767604 O\n0.767604 0.406426 0.593445 O\n0.593445 0.767604 0.406426 O\n0.292162 0.044691 0.942093 O\n0.719935 0.475693 0.882561 O\n0.117439 0.280065 0.524307 O\n0.016677 0.746888 0.641061 O\n0.232396 0.593574 0.406555 O\n0.044691 0.942093 0.292162 O\n0.746888 0.641061 0.016677 O\n0.280065 0.524307 0.117439 O\n0.406555 0.232396 0.593574 O\n0.253112 0.358939 0.983323 O\n0.593574 0.406555 0.232396 O\n0.057907 0.707838 0.955309 O\n0.983323 0.253112 0.358939 O\n0.955309 0.057907 0.707838 O\n0.475693 0.882561 0.719935 O\n0.641061 0.016677 0.746888 O\n0.358939 0.983323 0.253112 O\n0.882561 0.719935 0.475693 O\n0.707838 0.955309 0.057907 O\n0.524307 0.117439 0.280065 O\n0.942093 0.292162 0.044691 O\n",
"nsites": 36,
"nelements": 5,
"elements": [
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"Fe",
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],
"chemical_system": "Fe-O-P-Sn-Sr",
"density": 3.6661705739899553,
"density_atomic": 0.07264036602963979,
"volume": 495.59221638986173,
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"formula_full": "Sr2 Fe2 Sn2 P6 O24",
"formula_reduced": "SrFeSn(PO4)3",
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"energy": -275.19027352,
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"updated_at": "2021-11-28T01:34:25.778000Z",
"spacegroup": 148
}
]
}