{"count":146323,"next":"https://simmate.org/third-parties/MatprojStructure/?format=json&ordering=is_stable&page=34","previous":"https://simmate.org/third-parties/MatprojStructure/?format=json&ordering=is_stable&page=32","results":[{"id":"mp-1221353","created_at":"2022-09-04T14:46:29.667740Z","structure_string":"Na2 Eu1 Ge1 Se4\n1.0\n-3.703116 3.703116 3.728506\n3.703116 -3.703116 3.728506\n3.703116 3.703116 -3.728506\nNa Eu Ge Se\n2 1 1 4\ndirect\n0.000000 0.500000 0.500000 Na\n0.500000 0.000000 0.500000 Na\n0.500000 0.500000 0.000000 Eu\n0.000000 0.000000 0.000000 Ge\n0.004198 0.004198 0.377791 Se\n0.373594 0.995802 0.000000 Se\n0.995802 0.373594 0.000000 Se\n0.626406 0.626406 0.622209 Se\n","nsites":8,"nelements":4,"elements":["Na","Eu","Ge","Se"],"chemical_system":"Eu-Ge-Na-Se","density":4.761360020347146,"density_atomic":0.039116547513608664,"volume":204.5170268980614,"volume_molar":15.395379047460398,"formula_full":"Na2 Eu1 Ge1 Se4","formula_reduced":"Na2EuGeSe4","formula_anonymous":"ABC2D4","energy":-41.75257597,"energy_per_atom":-5.21907199625,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-39.86457597,"band_gap":0.1751,"is_gap_direct":true,"is_magnetic":true,"total_magnetization":7.0000261,"is_theoretical":true,"updated_at":"2021-11-28T01:37:31.715000Z","spacegroup":121},{"id":"mp-690372","created_at":"2022-09-04T14:46:29.671053Z","structure_string":"K4 Na2 Mo2 O6 F6\n1.0\n6.025996 0.000000 0.000000\n0.000000 6.025996 0.000000\n0.000000 0.000000 8.673098\nK Na Mo O F\n4 2 2 6 6\ndirect\n0.500000 0.000000 0.758320 K\n0.000000 0.500000 0.258320 K\n0.500000 0.000000 0.258320 K\n0.000000 0.500000 0.758320 K\n0.500000 0.500000 0.505430 Na\n0.000000 0.000000 0.005430 Na\n0.500000 0.500000 0.022577 Mo\n0.000000 0.000000 0.522577 Mo\n0.500000 0.500000 0.227616 O\n0.712390 0.287610 0.980779 O\n0.212390 0.212390 0.480779 O\n0.000000 0.000000 0.727616 O\n0.787610 0.787610 0.480779 O\n0.287610 0.712390 0.980779 O\n0.236168 0.763832 0.503225 F\n0.500000 0.500000 0.765632 F\n0.263832 0.263832 0.003225 F\n0.000000 0.000000 0.265632 F\n0.736168 0.736168 0.003225 F\n0.763832 0.236168 0.503225 F\n","nsites":20,"nelements":5,"elements":["K","Na","Mo","O","F"],"chemical_system":"F-K-Mo-Na-O","density":3.1858573031525554,"density_atomic":0.06350355874948946,"volume":314.94297947767836,"volume_molar":9.483154768941851,"formula_full":"K4 Na2 Mo2 O6 F6","formula_reduced":"K2NaMo(OF)3","formula_anonymous":"ABC2D3E3","energy":-120.51369199,"energy_per_atom":-6.0256845995,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-107.21569199,"band_gap":3.2003,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":6.17e-05,"is_theoretical":true,"updated_at":"2021-11-28T01:37:40.587000Z","spacegroup":102},{"id":"mp-1043481","created_at":"2022-09-04T14:46:29.672889Z","structure_string":"Mg4 Ni4 Bi4 P8 O36\n1.0\n6.616890 0.000000 0.000000\n0.000000 7.746186 0.000000\n0.000000 0.000000 14.214938\nMg Ni Bi P O\n4 4 4 8 36\ndirect\n0.750000 0.956750 0.798105 Mg\n0.750000 0.543250 0.298105 Mg\n0.250000 0.043250 0.201895 Mg\n0.250000 0.456750 0.701895 Mg\n0.500000 0.000000 0.000000 Ni\n0.500000 0.500000 0.500000 Ni\n0.000000 0.500000 0.500000 Ni\n0.000000 0.000000 0.000000 Ni\n0.750000 0.366636 0.883101 Bi\n0.250000 0.633364 0.116899 Bi\n0.250000 0.866636 0.616899 Bi\n0.750000 0.133364 0.383101 Bi\n0.250000 0.340918 0.905659 P\n0.750000 0.659082 0.094341 P\n0.750000 0.840918 0.594341 P\n0.250000 0.159082 0.405659 P\n0.750000 0.357935 0.677141 P\n0.250000 0.642065 0.322859 P\n0.250000 0.857935 0.822859 P\n0.750000 0.142065 0.177141 P\n0.048360 0.635550 0.379238 O\n0.548360 0.364450 0.620762 O\n0.951640 0.135550 0.120762 O\n0.451640 0.864450 0.879238 O\n0.951640 0.364450 0.620762 O\n0.451640 0.635550 0.379238 O\n0.048360 0.864450 0.879238 O\n0.548360 0.135550 0.120762 O\n0.250000 0.329848 0.459605 O\n0.750000 0.670152 0.540395 O\n0.750000 0.829848 0.040395 O\n0.250000 0.170152 0.959605 O\n0.750000 0.096151 0.928216 O\n0.250000 0.903849 0.071784 O\n0.250000 0.596151 0.571784 O\n0.750000 0.403849 0.428216 O\n0.750000 0.194525 0.741207 O\n0.250000 0.805475 0.258793 O\n0.250000 0.694525 0.758793 O\n0.750000 0.305475 0.241207 O\n0.426183 0.143245 0.333538 O\n0.926183 0.856755 0.666462 O\n0.573817 0.643245 0.166462 O\n0.073817 0.356755 0.833538 O\n0.573817 0.856755 0.666462 O\n0.073817 0.143245 0.333538 O\n0.426183 0.356755 0.833538 O\n0.926183 0.643245 0.166462 O\n0.750000 0.983027 0.247616 O\n0.250000 0.016973 0.752384 O\n0.250000 0.483027 0.252384 O\n0.750000 0.516973 0.747616 O\n0.750000 0.998507 0.528438 O\n0.250000 0.001493 0.471562 O\n0.250000 0.498507 0.971562 O\n0.750000 0.501493 0.028438 O\n","nsites":56,"nelements":5,"elements":["Mg","Ni","Bi","P","O"],"chemical_system":"Bi-Mg-Ni-O-P","density":4.539234925365154,"density_atomic":0.07686014886529506,"volume":728.5960387371288,"volume_molar":7.835192682952503,"formula_full":"Mg4 Ni4 Bi4 P8 O36","formula_reduced":"MgNiBiP2O9","formula_anonymous":"ABCD2E9","energy":-393.47751953,"energy_per_atom":-7.026384277321428,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-358.58151953,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":4.728756,"is_theoretical":true,"updated_at":"2021-11-28T01:37:41.529000Z","spacegroup":62},{"id":"mp-686724","created_at":"2022-09-04T14:46:29.679910Z","structure_string":"Sr2 La14 Mg4 Ga12 O45\n1.0\n4.824322 -0.009015 2.758494\n1.595158 4.581206 2.764217\n-0.378741 -0.213333 44.847278\nSr La Mg Ga O\n2 14 4 12 45\ndirect\n0.259197 0.262292 0.024143 Sr\n0.256131 0.256049 0.154477 Sr\n0.277443 0.252426 0.278716 La\n0.793749 0.736804 0.088882 La\n0.208604 0.231874 0.415206 La\n0.755707 0.744416 0.215755 La\n0.245752 0.242055 0.533756 La\n0.704217 0.792427 0.349424 La\n0.246872 0.246071 0.657210 La\n0.747805 0.752340 0.470477 La\n0.253149 0.252564 0.779450 La\n0.751583 0.748628 0.595052 La\n0.252604 0.266998 0.901792 La\n0.750453 0.749982 0.718240 La\n0.749784 0.750248 0.841917 La\n0.750448 0.757546 0.963572 La\n0.969008 0.960927 0.256920 Mg\n0.948476 0.981504 0.380904 Mg\n0.536739 0.513455 0.184886 Mg\n0.521226 0.520753 0.315379 Mg\n0.005934 0.013666 0.993869 Ga\n0.985275 0.001286 0.128640 Ga\n0.528017 0.527968 0.051976 Ga\n0.992170 0.983957 0.504156 Ga\n0.997775 0.995809 0.626296 Ga\n0.486706 0.495487 0.440319 Ga\n0.000435 0.000101 0.749450 Ga\n0.498242 0.495240 0.564832 Ga\n0.004271 0.006548 0.871946 Ga\n0.500429 0.499911 0.687724 Ga\n0.506184 0.504238 0.810443 Ga\n0.503512 0.508727 0.934101 Ga\n0.270050 0.766568 0.022749 O\n0.263167 0.615227 0.093153 O\n0.688261 0.179641 0.042771 O\n0.899519 0.271644 0.087185 O\n0.338535 0.862824 0.135955 O\n0.800183 0.722787 0.020541 O\n0.176492 0.673339 0.221405 O\n0.699343 0.215660 0.163058 O\n0.759271 0.275452 0.222502 O\n0.344994 0.896983 0.258377 O\n0.820912 0.712887 0.156489 O\n0.190797 0.838752 0.336421 O\n0.651869 0.218715 0.293834 O\n0.181060 0.298236 0.468972 O\n0.587700 0.214977 0.361421 O\n0.293033 0.774749 0.401042 O\n0.868251 0.625115 0.298831 O\n0.215872 0.778419 0.467846 O\n0.765500 0.229301 0.411987 O\n0.180359 0.312195 0.594279 O\n0.673921 0.204491 0.481525 O\n0.327321 0.749993 0.524403 O\n0.779031 0.678549 0.418514 O\n0.236185 0.810726 0.587682 O\n0.760811 0.185673 0.540968 O\n0.180984 0.319150 0.719344 O\n0.671733 0.232918 0.605178 O\n0.320054 0.749845 0.648512 O\n0.813945 0.670227 0.539094 O\n0.253191 0.819196 0.710277 O\n0.752813 0.180908 0.665464 O\n0.188402 0.321196 0.844077 O\n0.682076 0.248596 0.727273 O\n0.318290 0.749070 0.772192 O\n0.819292 0.675975 0.658715 O\n0.265749 0.827910 0.832550 O\n0.748121 0.178765 0.789278 O\n0.187626 0.326304 0.967657 O\n0.692807 0.267829 0.849222 O\n0.310080 0.737639 0.896308 O\n0.824538 0.680709 0.779276 O\n0.269407 0.837311 0.954957 O\n0.748892 0.182243 0.912560 O\n0.711188 0.295935 0.970245 O\n0.816878 0.696677 0.899755 O\n","nsites":77,"nelements":5,"elements":["Sr","La","Mg","Ga","O"],"chemical_system":"Ga-La-Mg-O-Sr","density":6.275768776962377,"density_atomic":0.07711366442594406,"volume":998.526014464619,"volume_molar":7.809434041074977,"formula_full":"Sr2 La14 Mg4 Ga12 O45","formula_reduced":"Sr2La14Mg4(Ga4O15)3","formula_anonymous":"A2B4C12D14E45","energy":-576.37337925,"energy_per_atom":-7.485368561688311,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-545.45837925,"band_gap":2.7118,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0001185,"is_theoretical":true,"updated_at":"2021-11-28T01:37:40.496000Z","spacegroup":1},{"id":"mp-780410","created_at":"2022-09-04T14:46:29.685295Z","structure_string":"Na12 V4 B8 P2 O32\n1.0\n0.000000 7.016437 7.016437\n7.016437 0.000000 7.016437\n7.016437 7.016437 0.000000\nNa V B P O\n12 4 8 2 32\ndirect\n0.290161 0.709839 0.709839 Na\n0.959839 0.959839 0.540161 Na\n0.709839 0.290161 0.709839 Na\n0.290161 0.709839 0.290161 Na\n0.540161 0.959839 0.959839 Na\n0.540161 0.540161 0.959839 Na\n0.709839 0.290161 0.290161 Na\n0.709839 0.709839 0.290161 Na\n0.540161 0.959839 0.540161 Na\n0.959839 0.540161 0.959839 Na\n0.290161 0.290161 0.709839 Na\n0.959839 0.540161 0.540161 Na\n0.625000 0.125000 0.125000 V\n0.125000 0.625000 0.125000 V\n0.125000 0.125000 0.625000 V\n0.125000 0.125000 0.125000 V\n0.257529 0.914157 0.914157 B\n0.914157 0.257529 0.914157 B\n0.914157 0.914157 0.914157 B\n0.914157 0.914157 0.257529 B\n0.335843 0.335843 0.992471 B\n0.335843 0.335843 0.335843 B\n0.335843 0.992471 0.335843 B\n0.992471 0.335843 0.335843 B\n0.500000 0.500000 0.500000 P\n0.750000 0.750000 0.750000 P\n0.219839 0.988383 0.490991 O\n0.988383 0.219839 0.300787 O\n0.261617 0.949213 0.759009 O\n0.261617 0.759009 0.030161 O\n0.564010 0.564010 0.307971 O\n0.949213 0.030161 0.759009 O\n0.030161 0.759009 0.949213 O\n0.564010 0.564010 0.564010 O\n0.564010 0.307971 0.564010 O\n0.949213 0.261617 0.030161 O\n0.759009 0.261617 0.949213 O\n0.307971 0.564010 0.564010 O\n0.030161 0.949213 0.261617 O\n0.759009 0.949213 0.030161 O\n0.949213 0.759009 0.261617 O\n0.490991 0.219839 0.988383 O\n0.759009 0.030161 0.261617 O\n0.300787 0.490991 0.988383 O\n0.490991 0.300787 0.219839 O\n0.219839 0.300787 0.988383 O\n0.942029 0.685990 0.685990 O\n0.490991 0.988383 0.300787 O\n0.300787 0.988383 0.219839 O\n0.685990 0.942029 0.685990 O\n0.685990 0.685990 0.685990 O\n0.219839 0.490991 0.300787 O\n0.300787 0.219839 0.490991 O\n0.685990 0.685990 0.942029 O\n0.988383 0.490991 0.219839 O\n0.988383 0.300787 0.490991 O\n0.261617 0.030161 0.949213 O\n0.030161 0.261617 0.759009 O\n","nsites":58,"nelements":5,"elements":["Na","V","B","P","O"],"chemical_system":"B-Na-O-P-V","density":2.740291417719247,"density_atomic":0.08395529803723223,"volume":690.8438342304299,"volume_molar":7.1730324360581985,"formula_full":"Na12 V4 B8 P2 O32","formula_reduced":"Na6V2B4PO16","formula_anonymous":"AB2C4D6E16","energy":-421.39271154,"energy_per_atom":-7.265391578275862,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-392.60871154,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":1.9994465,"is_theoretical":true,"updated_at":"2021-11-28T01:37:30.208000Z","spacegroup":203},{"id":"mp-1096240","created_at":"2022-09-04T14:46:29.731816Z","structure_string":"Hf1 Mg1 Ni2\n1.0\n-4.819956 4.842667 6.847288\n4.819956 -4.842667 6.847288\n4.819956 4.842667 -6.847288\nHf Mg Ni\n1 1 2\ndirect\n0.000000 0.500000 0.500000 Hf\n0.000000 0.000000 0.000000 Mg\n0.000000 0.272952 0.272952 Ni\n0.000000 0.727048 0.727048 Ni\n","nsites":4,"nelements":3,"elements":["Hf","Mg","Ni"],"chemical_system":"Hf-Mg-Ni","density":0.8316478574897984,"density_atomic":0.006256820921472422,"volume":639.3022990753389,"volume_molar":96.24921083058271,"formula_full":"Hf1 Mg1 Ni2","formula_reduced":"HfMgNi2","formula_anonymous":"ABC2","energy":-14.24772711,"energy_per_atom":-3.5619317775,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-14.24772711,"band_gap":0.6561999999999999,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.002495,"is_theoretical":true,"updated_at":"2021-11-28T01:37:36.666000Z","spacegroup":71},{"id":"mp-1523337","created_at":"2022-09-04T14:46:29.736769Z","structure_string":"K1 La1 Ce1 Hf1 O6\n1.0\n0.000000 -4.276236 -4.276236\n4.276236 -0.000000 -4.276236\n4.276236 -4.276236 -0.000000\nK La Ce Hf O\n1 1 1 1 6\ndirect\n0.750000 0.750000 0.750000 K\n0.250000 0.250000 0.250000 La\n0.000000 0.000000 0.000000 Ce\n0.500000 0.500000 0.500000 Hf\n0.741523 0.258477 0.258477 O\n0.258477 0.741523 0.741523 O\n0.741523 0.258477 0.741523 O\n0.258477 0.741523 0.258477 O\n0.741523 0.741523 0.258477 O\n0.258477 0.258477 0.741523 O\n","nsites":10,"nelements":5,"elements":["K","La","Ce","Hf","O"],"chemical_system":"Ce-Hf-K-La-O","density":6.292167491611052,"density_atomic":0.06394182216002349,"volume":156.39216497417885,"volume_molar":9.41815631235647,"formula_full":"K1 La1 Ce1 Hf1 O6","formula_reduced":"KLaCeHfO6","formula_anonymous":"ABCDE6","energy":-85.95875916,"energy_per_atom":-8.595875916,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-81.83675916,"band_gap":2.0577,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0,"is_theoretical":true,"updated_at":"2021-11-28T01:37:35.352000Z","spacegroup":216},{"id":"mp-387","created_at":"2022-09-04T14:46:30.293763Z","structure_string":"Ce1 Sb1\n1.0\n0.000000 3.185131 3.185131\n3.185131 0.000000 3.185131\n3.185131 3.185131 0.000000\nCe Sb\n1 1\ndirect\n0.000000 0.000000 0.000000 Ce\n0.500000 0.500000 0.500000 Sb\n","nsites":2,"nelements":2,"elements":["Ce","Sb"],"chemical_system":"Ce-Sb","density":6.728726926954054,"density_atomic":0.030946967804398155,"volume":64.62668693880121,"volume_molar":19.45955027989572,"formula_full":"Ce1 Sb1","formula_reduced":"CeSb","formula_anonymous":"AB","energy":-12.37084957,"energy_per_atom":-6.185424785,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-12.17884957,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":0.9040693,"is_theoretical":false,"updated_at":"2021-11-28T01:37:33.612000Z","spacegroup":225},{"id":"mp-25953","created_at":"2022-09-04T14:46:29.700142Z","structure_string":"Li6 Co6 P6 O24\n1.0\n3.734063 -6.467587 0.000000\n3.734063 6.467587 0.000000\n0.000000 0.000000 9.510142\nLi Co P O\n6 6 6 24\ndirect\n0.047717 0.256697 0.252174 Li\n0.743303 0.791020 0.252174 Li\n0.208980 0.952283 0.252174 Li\n0.952283 0.208980 0.752174 Li\n0.256697 0.047717 0.752174 Li\n0.791020 0.743303 0.752174 Li\n0.591660 0.050004 0.978565 Co\n0.949996 0.541657 0.978565 Co\n0.408340 0.458343 0.478565 Co\n0.050004 0.591660 0.478565 Co\n0.458343 0.408340 0.978565 Co\n0.541657 0.949996 0.478565 Co\n0.666667 0.333333 0.676384 P\n0.000000 0.000000 0.999951 P\n0.333333 0.666667 0.176384 P\n0.333333 0.666667 0.772531 P\n0.000000 0.000000 0.499951 P\n0.666667 0.333333 0.272531 P\n0.885820 0.389438 0.321384 O\n0.831927 0.550369 0.624049 O\n0.449631 0.281558 0.624049 O\n0.333333 0.666667 0.603763 O\n0.666667 0.333333 0.842428 O\n0.168073 0.718442 0.124049 O\n0.123231 0.224838 0.441447 O\n0.101607 0.876769 0.441447 O\n0.000000 0.000000 0.162051 O\n0.503618 0.114180 0.321384 O\n0.876769 0.101607 0.941447 O\n0.718442 0.168073 0.624049 O\n0.610562 0.496382 0.321384 O\n0.666667 0.333333 0.103763 O\n0.114180 0.503618 0.821384 O\n0.224838 0.123231 0.941447 O\n0.550369 0.831927 0.124049 O\n0.496382 0.610562 0.821384 O\n0.000000 0.000000 0.662051 O\n0.281558 0.449631 0.124049 O\n0.898393 0.775162 0.941447 O\n0.333333 0.666667 0.342428 O\n0.389438 0.885820 0.821384 O\n0.775162 0.898393 0.441447 O\n","nsites":42,"nelements":4,"elements":["Li","Co","P","O"],"chemical_system":"Co-Li-O-P","density":3.488739152584734,"density_atomic":0.09143413753936779,"volume":459.3470352571164,"volume_molar":6.586315485731042,"formula_full":"Li6 Co6 P6 O24","formula_reduced":"LiCoPO4","formula_anonymous":"ABCD4","energy":-304.12050822,"energy_per_atom":-7.240964481428571,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-277.80450822,"band_gap":2.9335,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":18.0000597,"is_theoretical":true,"updated_at":"2021-11-28T01:37:31.440000Z","spacegroup":159},{"id":"mp-542450","created_at":"2022-09-04T14:46:29.716657Z","structure_string":"Cs3 Mn4 P12 O36\n1.0\n5.089565 8.238834 0.000000\n-5.089565 8.238834 0.000000\n0.000000 7.604843 10.079514\nCs Mn P O\n3 4 12 36\ndirect\n0.000000 0.000000 0.500000 Cs\n0.784218 0.215782 0.000000 Cs\n0.215782 0.784218 0.000000 Cs\n0.208192 0.208192 0.588525 Mn\n0.791808 0.791808 0.411475 Mn\n0.749438 0.749438 0.927186 Mn\n0.250562 0.250562 0.072814 Mn\n0.834974 0.418745 0.199706 P\n0.581255 0.165026 0.800294 P\n0.165026 0.581255 0.800294 P\n0.418745 0.834974 0.199706 P\n0.606494 0.197833 0.371606 P\n0.802167 0.393506 0.628394 P\n0.393506 0.802167 0.628394 P\n0.197833 0.606494 0.371606 P\n0.333188 0.333188 0.273215 P\n0.666812 0.666812 0.726785 P\n0.762032 0.762032 0.175215 P\n0.237968 0.237968 0.824785 P\n0.680071 0.346564 0.328479 O\n0.653436 0.319929 0.671521 O\n0.319929 0.653436 0.671521 O\n0.346564 0.680071 0.328479 O\n0.994997 0.294038 0.209809 O\n0.705962 0.005003 0.790191 O\n0.005003 0.705962 0.790191 O\n0.294038 0.994997 0.209809 O\n0.813889 0.563832 0.239698 O\n0.436168 0.186111 0.760302 O\n0.186111 0.436168 0.760302 O\n0.563832 0.813889 0.239698 O\n0.800352 0.491347 0.075648 O\n0.508653 0.199648 0.924352 O\n0.199648 0.508653 0.924352 O\n0.491347 0.800352 0.075648 O\n0.750654 0.054689 0.344002 O\n0.945311 0.249346 0.655998 O\n0.249346 0.945311 0.655998 O\n0.054689 0.750654 0.344002 O\n0.473341 0.177601 0.506362 O\n0.822399 0.526659 0.493638 O\n0.526659 0.822399 0.493638 O\n0.177601 0.473341 0.506362 O\n0.524088 0.274519 0.260859 O\n0.725481 0.475912 0.739141 O\n0.475912 0.725481 0.739141 O\n0.274519 0.524088 0.260859 O\n0.338949 0.338949 0.150405 O\n0.661051 0.661051 0.849595 O\n0.230422 0.230422 0.407402 O\n0.769578 0.769578 0.592598 O\n0.825624 0.825624 0.225124 O\n0.174376 0.174376 0.774876 O\n0.822761 0.822761 0.026523 O\n0.177239 0.177239 0.973477 O\n","nsites":55,"nelements":4,"elements":["Cs","Mn","P","O"],"chemical_system":"Cs-Mn-O-P","density":3.0765322862377156,"density_atomic":0.0650648875648973,"volume":845.3099983480593,"volume_molar":9.255592356158873,"formula_full":"Cs3 Mn4 P12 O36","formula_reduced":"Cs3Mn4(PO3)12","formula_anonymous":"A3B4C12D36","energy":-426.43899802,"energy_per_atom":-7.753436327636363,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-395.03499802,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":18.915231,"is_theoretical":false,"updated_at":"2021-11-28T01:37:41.993000Z","spacegroup":12},{"id":"mp-1220051","created_at":"2022-09-04T14:46:29.754714Z","structure_string":"Nd1 Ho1 Al4\n1.0\n0.000000 3.973176 3.973176\n3.973176 0.000000 3.973176\n3.973176 3.973176 0.000000\nNd Ho Al\n1 1 4\ndirect\n0.000000 0.000000 0.000000 Nd\n0.250000 0.250000 0.250000 Ho\n0.624918 0.624918 0.125245 Al\n0.624918 0.125245 0.624918 Al\n0.125245 0.624918 0.624918 Al\n0.624918 0.624918 0.624918 Al\n","nsites":6,"nelements":3,"elements":["Nd","Ho","Al"],"chemical_system":"Al-Ho-Nd","density":5.5213374740248655,"density_atomic":0.04783082198230812,"volume":125.4421260462408,"volume_molar":12.59050233806874,"formula_full":"Nd1 Ho1 Al4","formula_reduced":"NdHoAl4","formula_anonymous":"ABC4","energy":-27.32166399,"energy_per_atom":-4.553610665,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-27.32166399,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0093931,"is_theoretical":true,"updated_at":"2021-11-28T01:37:36.983000Z","spacegroup":216},{"id":"mp-1171010","created_at":"2022-09-04T14:46:28.406286Z","structure_string":"Ca1 Fe2 Si4 O12\n1.0\n4.461243 4.885879 0.000000\n-4.461243 4.885879 0.000000\n0.000000 1.574924 5.102472\nCa Fe Si O\n1 2 4 12\ndirect\n0.304077 0.695923 0.500000 Ca\n0.091707 0.908293 0.000000 Fe\n0.888773 0.111227 0.500000 Fe\n0.799094 0.618253 0.486162 Si\n0.621462 0.798306 0.977915 Si\n0.201694 0.378538 0.022085 Si\n0.381747 0.200906 0.513838 Si\n0.044086 0.186973 0.118451 O\n0.610152 0.095831 0.458337 O\n0.198367 0.029963 0.609356 O\n0.655235 0.645955 0.261101 O\n0.904169 0.389848 0.541663 O\n0.813027 0.955914 0.881549 O\n0.383625 0.885809 0.060985 O\n0.114191 0.616375 0.939015 O\n0.628263 0.664956 0.747384 O\n0.354045 0.344765 0.738899 O\n0.970037 0.801633 0.390644 O\n0.335044 0.371737 0.252616 O\n","nsites":19,"nelements":4,"elements":["Ca","Fe","Si","O"],"chemical_system":"Ca-Fe-O-Si","density":3.4048863711889563,"density_atomic":0.08541701456725069,"volume":222.43811840369207,"volume_molar":7.050282417982002,"formula_full":"Ca1 Fe2 Si4 O12","formula_reduced":"CaFe2(SiO3)4","formula_anonymous":"AB2C4D12","energy":-154.67513715,"energy_per_atom":-8.140796692105264,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-141.91913715,"band_gap":1.8921,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":9.9992308,"is_theoretical":true,"updated_at":"2021-11-28T01:37:38.016000Z","spacegroup":5}]}