{"count":146323,"next":"https://simmate.org/third-parties/MatprojStructure/?format=json&ordering=-formula_full&page=10137","previous":"https://simmate.org/third-parties/MatprojStructure/?format=json&ordering=-formula_full&page=10135","results":[{"id":"mp-1206931","created_at":"2022-09-04T14:46:52.728801Z","structure_string":"Cr2 B4 Mo4\n1.0\n5.842820 0.000000 0.000000\n0.000000 5.842820 0.000000\n0.000000 0.000000 3.126887\nCr B Mo\n2 4 4\ndirect\n0.000000 0.000000 0.000000 Cr\n0.500000 0.500000 0.000000 Cr\n0.113629 0.613629 0.000000 B\n0.886371 0.386371 0.000000 B\n0.613629 0.886371 0.000000 B\n0.386371 0.113629 0.000000 B\n0.677379 0.177379 0.500000 Mo\n0.322621 0.822621 0.500000 Mo\n0.177379 0.322621 0.500000 Mo\n0.822621 0.677379 0.500000 Mo\n","nsites":10,"nelements":3,"elements":["Cr","B","Mo"],"chemical_system":"B-Cr-Mo","density":8.26006204094469,"density_atomic":0.09367911919914307,"volume":106.74737428670737,"volume_molar":6.428477137149564,"formula_full":"Cr2 B4 Mo4","formula_reduced":"Cr(BMo)2","formula_anonymous":"AB2C2","energy":-93.83285483,"energy_per_atom":-9.383285483,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-93.83285483,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0833866,"is_theoretical":true,"updated_at":"2021-11-28T01:37:38.227000Z","spacegroup":127},{"id":"mp-1226225","created_at":"2022-09-04T14:40:58.060290Z","structure_string":"Cr2 B2 W2\n1.0\n2.718591 -2.718591 -2.292135\n-2.681525 -2.681525 2.292135\n-2.681525 -2.681525 -2.292135\nCr B W\n2 2 2\ndirect\n0.500000 0.328934 0.828934 Cr\n0.500000 0.671066 0.171066 Cr\n0.000000 0.250000 0.750000 B\n0.000000 0.750000 0.250000 B\n0.168601 0.834301 0.665699 W\n0.831399 0.165699 0.334301 W\n","nsites":6,"nelements":3,"elements":["Cr","B","W"],"chemical_system":"B-Cr-W","density":12.255448167690492,"density_atomic":0.0897687837824422,"volume":66.8383790799841,"volume_molar":6.7085021164983925,"formula_full":"Cr2 B2 W2","formula_reduced":"CrBW","formula_anonymous":"ABC","energy":-59.9840506,"energy_per_atom":-9.997341766666667,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-59.9840506,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":0.1459384,"is_theoretical":true,"updated_at":"2021-11-28T01:35:01.176000Z","spacegroup":69},{"id":"mp-19299","created_at":"2022-09-04T14:48:16.861252Z","structure_string":"Cr2 B2 O6\n1.0\n4.231731 0.010887 3.595141\n1.669567 3.888472 3.595141\n0.016477 0.010887 5.552685\nCr B O\n2 2 6\ndirect\n0.500000 0.500000 0.500000 Cr\n0.000000 0.000000 0.000000 Cr\n0.750000 0.750000 0.750000 B\n0.250000 0.250000 0.250000 B\n0.452009 0.047991 0.750000 O\n0.750000 0.452009 0.047991 O\n0.952009 0.250000 0.547991 O\n0.547991 0.952009 0.250000 O\n0.250000 0.547991 0.952009 O\n0.047991 0.750000 0.452009 O\n","nsites":10,"nelements":3,"elements":["Cr","B","O"],"chemical_system":"B-Cr-O","density":4.04662161929299,"density_atomic":0.1099646181286592,"volume":90.93834153363717,"volume_molar":5.476434931965173,"formula_full":"Cr2 B2 O6","formula_reduced":"CrBO3","formula_anonymous":"ABC3","energy":-88.55383028,"energy_per_atom":-8.855383028,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-80.43383028,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":6.0000001,"is_theoretical":false,"updated_at":"2021-11-28T01:38:53.863000Z","spacegroup":167},{"id":"mp-1246479","created_at":"2022-09-04T14:41:21.687596Z","structure_string":"Cr2 B2 N4\n1.0\n3.120056 0.000000 0.000000\n-1.560027 2.702141 0.000000\n0.000000 0.000000 9.598127\nCr B N\n2 2 4\ndirect\n0.000000 0.000000 0.000000 Cr\n0.000000 0.000000 0.500000 Cr\n0.666694 0.333388 0.250000 B\n0.333306 0.666612 0.750000 B\n0.666682 0.333362 0.110375 N\n0.333318 0.666638 0.889625 N\n0.333318 0.666638 0.610375 N\n0.666682 0.333362 0.389625 N\n","nsites":8,"nelements":3,"elements":["Cr","B","N"],"chemical_system":"B-Cr-N","density":3.727400794379799,"density_atomic":0.09886284378724251,"volume":80.92018895608926,"volume_molar":6.091409602742088,"formula_full":"Cr2 B2 N4","formula_reduced":"CrBN2","formula_anonymous":"ABC2","energy":-71.37910476,"energy_per_atom":-8.922388095,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-69.93510476,"band_gap":0.6791999999999998,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":6.0016733,"is_theoretical":true,"updated_at":"2021-11-28T01:35:29.882000Z","spacegroup":194},{"id":"mp-260","created_at":"2022-09-04T14:42:27.709486Z","structure_string":"Cr2 B2\n1.0\n1.463308 -3.925437 0.000000\n1.463308 3.925437 0.000000\n0.000000 0.000000 2.916397\nCr B\n2 2\ndirect\n0.854533 0.145467 0.750000 Cr\n0.145467 0.854533 0.250000 Cr\n0.564426 0.435574 0.750000 B\n0.435574 0.564426 0.250000 B\n","nsites":4,"nelements":2,"elements":["Cr","B"],"chemical_system":"B-Cr","density":6.225689217418206,"density_atomic":0.11938770237206656,"volume":33.50428830210816,"volume_molar":5.044188505472919,"formula_full":"Cr2 B2","formula_reduced":"CrB","formula_anonymous":"AB","energy":-34.74558514,"energy_per_atom":-8.686396285,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-34.74558514,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0067794,"is_theoretical":false,"updated_at":"2021-11-28T01:35:51.583000Z","spacegroup":63},{"id":"mp-1197470","created_at":"2022-09-04T14:45:21.380988Z","structure_string":"Cr2 B12 H72 C16 O4\n1.0\n7.451571 0.000000 0.000000\n0.000000 17.826270 0.000000\n-2.960657 0.000000 7.962440\nCr B H C O\n2 12 72 16 4\ndirect\n0.500000 0.500000 0.500000 Cr\n0.500000 0.000000 0.000000 Cr\n0.258788 0.461689 0.652504 B\n0.741212 0.961689 0.847496 B\n0.741212 0.538311 0.347496 B\n0.258788 0.038311 0.152504 B\n0.488178 0.420128 0.753031 B\n0.511822 0.920128 0.746969 B\n0.511822 0.579872 0.246969 B\n0.488178 0.079872 0.253031 B\n0.277890 0.361963 0.684405 B\n0.722110 0.861963 0.815595 B\n0.722110 0.638037 0.315595 B\n0.277890 0.138037 0.184405 B\n0.231202 0.491072 0.514529 H\n0.768798 0.991072 0.985471 H\n0.768798 0.508928 0.485471 H\n0.231202 0.008928 0.014529 H\n0.211593 0.502254 0.744446 H\n0.788407 0.002254 0.755554 H\n0.788407 0.497746 0.255554 H\n0.211593 0.997746 0.244446 H\n0.125810 0.413322 0.601409 H\n0.874190 0.913322 0.898591 H\n0.874190 0.586678 0.398591 H\n0.125810 0.086678 0.101409 H\n0.600156 0.420575 0.674428 H\n0.399844 0.920575 0.825572 H\n0.399844 0.579425 0.325572 H\n0.600156 0.079425 0.174428 H\n0.562409 0.443470 0.893713 H\n0.437591 0.943470 0.606287 H\n0.437591 0.556530 0.106287 H\n0.562409 0.056530 0.393713 H\n0.482382 0.349659 0.768971 H\n0.517618 0.849659 0.731029 H\n0.517618 0.650341 0.231029 H\n0.482382 0.150341 0.268971 H\n0.222332 0.338269 0.792399 H\n0.777668 0.838269 0.707601 H\n0.777668 0.661731 0.207601 H\n0.222332 0.161731 0.292399 H\n0.255950 0.320400 0.567198 H\n0.744050 0.820400 0.932802 H\n0.744050 0.679600 0.432802 H\n0.255950 0.179600 0.067198 H\n0.405589 0.320323 0.187915 H\n0.594411 0.820323 0.312085 H\n0.594411 0.679677 0.812085 H\n0.405589 0.179677 0.687915 H\n0.565542 0.394731 0.187375 H\n0.434458 0.894731 0.312625 H\n0.434458 0.605269 0.812625 H\n0.565542 0.105269 0.687375 H\n0.732100 0.283223 0.363615 H\n0.267900 0.783223 0.136385 H\n0.267900 0.716777 0.636385 H\n0.732100 0.216777 0.863615 H\n0.761326 0.363590 0.492915 H\n0.238674 0.863590 0.007085 H\n0.238674 0.636410 0.507085 H\n0.761326 0.136410 0.992915 H\n0.589748 0.293617 0.491900 H\n0.410252 0.793617 0.008100 H\n0.410252 0.706383 0.508100 H\n0.589748 0.206383 0.991900 H\n0.153019 0.481967 0.216724 H\n0.846981 0.981967 0.283276 H\n0.846981 0.518033 0.783276 H\n0.153019 0.018033 0.716724 H\n0.244716 0.438539 0.072404 H\n0.755284 0.938539 0.427596 H\n0.755284 0.561461 0.927596 H\n0.244716 0.061461 0.572404 H\n0.929159 0.383750 0.059084 H\n0.070841 0.883750 0.440916 H\n0.070841 0.616250 0.940916 H\n0.929159 0.116250 0.559084 H\n0.108575 0.313661 0.121261 H\n0.891425 0.813661 0.378739 H\n0.891425 0.686339 0.878739 H\n0.108575 0.186339 0.621261 H\n0.027378 0.356928 0.274135 H\n0.972622 0.856928 0.225865 H\n0.972622 0.643072 0.725865 H\n0.027378 0.143072 0.774135 H\n0.504608 0.362034 0.266755 C\n0.495392 0.862034 0.233245 C\n0.495392 0.637966 0.733245 C\n0.504608 0.137966 0.766755 C\n0.655179 0.324204 0.413529 C\n0.344821 0.824204 0.086471 C\n0.344821 0.675796 0.586471 C\n0.655179 0.175796 0.913529 C\n0.207148 0.428962 0.185030 C\n0.792852 0.928962 0.314970 C\n0.792852 0.571038 0.814970 C\n0.207148 0.071038 0.685030 C\n0.061600 0.366572 0.160399 C\n0.938400 0.866572 0.339601 C\n0.938400 0.633428 0.839601 C\n0.061600 0.133428 0.660399 C\n0.386678 0.413448 0.323902 O\n0.613322 0.913448 0.176098 O\n0.613322 0.586552 0.676098 O\n0.386678 0.086552 0.823902 O\n","nsites":106,"nelements":5,"elements":["Cr","B","H","C","O"],"chemical_system":"B-C-Cr-H-O","density":0.8830592757844442,"density_atomic":0.10021930080369594,"volume":1057.6804981669845,"volume_molar":6.008963055725002,"formula_full":"Cr2 B12 H72 C16 O4","formula_reduced":"CrB6H36(C4O)2","formula_anonymous":"AB2C6D8E36","energy":-532.3407761899999,"energy_per_atom":-5.022082794245282,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-525.59477619,"band_gap":2.5602,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":8.1369242,"is_theoretical":false,"updated_at":"2021-11-28T01:37:04.284000Z","spacegroup":14},{"id":"mp-1201768","created_at":"2022-09-04T14:42:41.263934Z","structure_string":"Cr2 B12 H64 C16 O4\n1.0\n9.532044 0.000000 0.000000\n0.000000 9.083666 0.000000\n-6.947178 0.000000 11.728152\nCr B H C O\n2 12 64 16 4\ndirect\n0.000000 0.500000 0.500000 Cr\n0.000000 0.000000 0.000000 Cr\n0.742106 0.348563 0.354117 B\n0.742106 0.151437 0.854117 B\n0.257894 0.651437 0.645883 B\n0.257894 0.848563 0.145883 B\n0.832968 0.270671 0.493434 B\n0.832968 0.229329 0.993434 B\n0.167032 0.729329 0.506566 B\n0.167032 0.770671 0.006566 B\n0.803170 0.158709 0.375800 B\n0.803170 0.341291 0.875800 B\n0.196830 0.841291 0.624200 B\n0.196830 0.658709 0.124200 B\n0.971396 0.313971 0.564470 H\n0.971396 0.186029 0.064470 H\n0.028604 0.686029 0.435530 H\n0.028604 0.813971 0.935530 H\n0.742140 0.273027 0.530441 H\n0.742140 0.226973 0.030441 H\n0.257860 0.726973 0.469559 H\n0.257860 0.773027 0.969559 H\n0.869454 0.135883 0.496688 H\n0.869454 0.364117 0.996688 H\n0.130546 0.864117 0.503312 H\n0.130546 0.635883 0.003312 H\n0.922424 0.123296 0.371955 H\n0.922424 0.376704 0.871955 H\n0.077576 0.876704 0.628045 H\n0.077576 0.623296 0.128045 H\n0.603192 0.385340 0.318959 H\n0.603192 0.114660 0.818959 H\n0.396808 0.614660 0.681041 H\n0.396808 0.885340 0.181041 H\n0.732511 0.257835 0.280253 H\n0.732511 0.242165 0.780253 H\n0.267489 0.742165 0.719747 H\n0.267489 0.757835 0.219747 H\n0.822509 0.442545 0.338418 H\n0.822509 0.057455 0.838418 H\n0.177491 0.557455 0.661582 H\n0.177491 0.942545 0.161582 H\n0.693197 0.070735 0.340461 H\n0.693197 0.429265 0.840461 H\n0.306803 0.929265 0.659539 H\n0.306803 0.570735 0.159539 H\n0.486763 0.206011 0.539767 H\n0.486763 0.293989 0.039767 H\n0.513237 0.793989 0.460233 H\n0.513237 0.706011 0.960233 H\n0.317843 0.085470 0.473094 H\n0.317843 0.414530 0.973094 H\n0.682157 0.914530 0.526906 H\n0.682157 0.585470 0.026906 H\n0.251080 0.208776 0.302493 H\n0.251080 0.291224 0.802493 H\n0.748920 0.791224 0.697507 H\n0.748920 0.708776 0.197507 H\n0.385797 0.355814 0.375758 H\n0.385797 0.144186 0.875758 H\n0.614203 0.644186 0.624242 H\n0.614203 0.855814 0.124242 H\n0.218657 0.200502 0.578886 H\n0.218657 0.299498 0.078886 H\n0.781343 0.799498 0.421114 H\n0.781343 0.700502 0.921114 H\n0.364024 0.347185 0.621115 H\n0.364024 0.152815 0.121115 H\n0.635976 0.652815 0.378885 H\n0.635976 0.847185 0.878885 H\n0.156721 0.494472 0.337555 H\n0.156721 0.005528 0.837555 H\n0.843279 0.505528 0.662445 H\n0.843279 0.994472 0.162445 H\n0.027557 0.335332 0.292040 H\n0.027557 0.164668 0.792040 H\n0.972443 0.664668 0.707960 H\n0.972443 0.835332 0.207960 H\n0.277468 0.278336 0.549326 C\n0.277468 0.221664 0.049326 C\n0.722532 0.721664 0.450674 C\n0.722532 0.778336 0.950674 C\n0.146473 0.378940 0.357093 C\n0.146473 0.121060 0.857093 C\n0.853527 0.621060 0.642907 C\n0.853527 0.878940 0.142907 C\n0.353504 0.201874 0.487585 C\n0.353504 0.298126 0.987585 C\n0.646496 0.798126 0.512415 C\n0.646496 0.701874 0.012415 C\n0.290334 0.285354 0.373714 C\n0.290334 0.214646 0.873714 C\n0.709666 0.714646 0.626286 C\n0.709666 0.785354 0.126286 C\n0.150952 0.376437 0.465943 O\n0.150952 0.123563 0.965943 O\n0.849048 0.623563 0.534057 O\n0.849048 0.876437 0.034057 O\n","nsites":98,"nelements":5,"elements":["Cr","B","H","C","O"],"chemical_system":"B-C-Cr-H-O","density":0.9065597776723355,"density_atomic":0.09650488427145601,"volume":1015.4926430908763,"volume_molar":6.2402445279976515,"formula_full":"Cr2 B12 H64 C16 O4","formula_reduced":"CrB6H32(C4O)2","formula_anonymous":"AB2C6D8E32","energy":-502.13874,"energy_per_atom":-5.123864693877551,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-495.39274,"band_gap":2.7018,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":8.254815,"is_theoretical":false,"updated_at":"2021-11-28T01:35:51.107000Z","spacegroup":14},{"id":"mp-997159","created_at":"2022-09-04T14:44:16.049096Z","structure_string":"Cr2 Au2 O4\n1.0\n-1.537416 -2.662883 0.000000\n-3.074832 0.000000 0.000000\n0.000000 0.000000 -12.365458\nCr Au O\n2 2 4\ndirect\n0.000000 0.000000 0.500000 Cr\n0.000000 0.000000 0.000000 Cr\n0.666666 0.666667 0.250000 Au\n0.333334 0.333333 0.750000 Au\n0.333334 0.333333 0.580140 O\n0.333334 0.333333 0.919860 O\n0.666666 0.666667 0.419860 O\n0.666666 0.666667 0.080140 O\n","nsites":8,"nelements":3,"elements":["Cr","Au","O"],"chemical_system":"Au-Cr-O","density":9.215993804221641,"density_atomic":0.07901441026632762,"volume":101.2473544133916,"volume_molar":7.621572748188143,"formula_full":"Cr2 Au2 O4","formula_reduced":"CrAuO2","formula_anonymous":"ABC2","energy":-58.6255329,"energy_per_atom":-7.3281916125,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-51.8795329,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":2.06e-05,"is_theoretical":true,"updated_at":"2021-11-28T01:36:35.131000Z","spacegroup":194},{"id":"mp-996996","created_at":"2022-09-04T14:41:32.890376Z","structure_string":"Cr2 Au2 O4\n1.0\n-1.582362 2.635876 0.000000\n-4.367622 -2.621959 -11.404421\n-2.986583 0.000000 0.729403\nCr Au O\n2 2 4\ndirect\n0.250000 0.750000 0.500000 Cr\n0.750000 0.250000 0.500000 Cr\n0.000000 0.000000 0.000000 Au\n0.500000 0.500000 0.000000 Au\n0.056608 0.169823 0.886785 O\n0.556608 0.669823 0.886785 O\n0.443392 0.330177 0.113215 O\n0.943392 0.830177 0.113215 O\n","nsites":8,"nelements":3,"elements":["Cr","Au","O"],"chemical_system":"Au-Cr-O","density":9.220117994885612,"density_atomic":0.07904976950159429,"volume":101.20206612163057,"volume_molar":7.618163592341082,"formula_full":"Cr2 Au2 O4","formula_reduced":"CrAuO2","formula_anonymous":"ABC2","energy":-58.627615600000006,"energy_per_atom":-7.328451950000001,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-51.8816156,"band_gap":1.2660000000000005,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":0.0,"is_theoretical":true,"updated_at":"2021-11-28T01:35:25.895000Z","spacegroup":166},{"id":"mp-15681","created_at":"2022-09-04T14:47:20.313927Z","structure_string":"Cr2 As4\n1.0\n1.613278 4.460952 0.000000\n-1.613278 4.460952 0.000000\n0.000000 3.698608 6.439815\nCr As\n2 4\ndirect\n0.847111 0.847111 0.699790 Cr\n0.152889 0.152889 0.300210 Cr\n0.596314 0.596314 0.605466 As\n0.403686 0.403686 0.394534 As\n0.150226 0.150226 0.963090 As\n0.849774 0.849774 0.036910 As\n","nsites":6,"nelements":2,"elements":["Cr","As"],"chemical_system":"As-Cr","density":7.231771172980101,"density_atomic":0.06473081896763419,"volume":92.69155088243264,"volume_molar":9.30335944461186,"formula_full":"Cr2 As4","formula_reduced":"CrAs2","formula_anonymous":"AB2","energy":-38.66936956,"energy_per_atom":-6.444894926666667,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-38.66936956,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0016529,"is_theoretical":false,"updated_at":"2021-11-28T01:38:07.491000Z","spacegroup":12},{"id":"mp-568565","created_at":"2022-09-04T14:43:50.458154Z","structure_string":"Cr2 As2\n1.0\n1.821690 -3.155259 0.000000\n1.821690 3.155259 0.000000\n0.000000 0.000000 5.633955\nCr As\n2 2\ndirect\n0.000000 0.000000 0.000000 Cr\n0.000000 0.000000 0.500000 Cr\n0.333333 0.666667 0.250000 As\n0.666667 0.333333 0.750000 As\n","nsites":4,"nelements":2,"elements":["Cr","As"],"chemical_system":"As-Cr","density":6.508013248385811,"density_atomic":0.06175997810119183,"volume":64.7668623432172,"volume_molar":9.750879040359935,"formula_full":"Cr2 As2","formula_reduced":"CrAs","formula_anonymous":"AB","energy":-29.33510661,"energy_per_atom":-7.3337766525,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-29.33510661,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":4.7986648,"is_theoretical":false,"updated_at":"2021-11-28T01:36:19.874000Z","spacegroup":194},{"id":"mp-38021","created_at":"2022-09-04T14:48:20.642131Z","structure_string":"Cr2 As1 Se1\n1.0\n3.766159 0.000000 0.000000\n-1.883079 3.261589 0.000000\n0.000000 0.000000 6.234445\nCr As Se\n2 1 1\ndirect\n0.000000 0.000000 0.992003 Cr\n0.000000 0.000000 0.507997 Cr\n0.666667 0.333333 0.750000 As\n0.333333 0.666667 0.250000 Se\n","nsites":4,"nelements":3,"elements":["Cr","As","Se"],"chemical_system":"As-Cr-Se","density":5.591529681788527,"density_atomic":0.05223171771476621,"volume":76.58181991723349,"volume_molar":11.52966247996379,"formula_full":"Cr2 As1 Se1","formula_reduced":"Cr2AsSe","formula_anonymous":"ABC2","energy":-28.751784410000003,"energy_per_atom":-7.187946102500001,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-28.27978441,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":6.9672956,"is_theoretical":true,"updated_at":"2021-11-28T01:39:36.755000Z","spacegroup":187}]}