{"count":146323,"next":"https://simmate.org/third-parties/MatprojStructure/?format=json&ordering=-chemical_system&page=62","previous":"https://simmate.org/third-parties/MatprojStructure/?format=json&ordering=-chemical_system&page=60","results":[{"id":"mp-32891","created_at":"2022-09-04T14:47:18.968114Z","structure_string":"Y16 S24\n1.0\n-4.176584 4.176584 12.480237\n4.176584 -4.176584 12.480237\n4.176584 4.176584 -12.480237\nY S\n16 24\ndirect\n0.350922 0.451086 0.379242 Y\n0.071843 0.971680 0.620758 Y\n0.664888 0.664888 0.000000 Y\n0.375000 0.006603 0.131603 Y\n0.678157 0.798914 0.399837 Y\n0.085112 0.585112 0.500000 Y\n0.875000 0.243397 0.868397 Y\n0.399078 0.278320 0.600163 Y\n0.721680 0.321843 0.120758 Y\n0.414888 0.914888 0.500000 Y\n0.993397 0.125000 0.368397 Y\n0.756603 0.625000 0.631603 Y\n0.201086 0.600922 0.879242 Y\n0.335112 0.335112 0.000000 Y\n0.028320 0.649078 0.100163 Y\n0.548914 0.928157 0.899837 Y\n0.003714 0.618915 0.253909 S\n0.573636 0.327536 0.613570 S\n0.365006 0.749805 0.746091 S\n0.384994 0.631085 0.884799 S\n0.746286 0.500195 0.115201 S\n0.713966 0.960066 0.386430 S\n0.343504 0.938126 0.246978 S\n0.036034 0.922464 0.746100 S\n0.903474 0.656496 0.594622 S\n0.691148 0.096526 0.753022 S\n0.176364 0.289934 0.253900 S\n0.710066 0.963966 0.886430 S\n0.077536 0.823636 0.113570 S\n0.061874 0.308852 0.405378 S\n0.672464 0.286034 0.246100 S\n0.368915 0.253714 0.753909 S\n0.250195 0.996286 0.615201 S\n0.039934 0.426364 0.753900 S\n0.499805 0.615006 0.246091 S\n0.058852 0.311874 0.905378 S\n0.406496 0.153474 0.094622 S\n0.381085 0.634994 0.384799 S\n0.688126 0.593504 0.746978 S\n0.846526 0.941148 0.253022 S\n","nsites":40,"nelements":2,"elements":["Y","S"],"chemical_system":"S-Y","density":4.179987681547378,"density_atomic":0.04593404869669872,"volume":870.8137239135814,"volume_molar":13.110407052868414,"formula_full":"Y16 S24","formula_reduced":"Y2S3","formula_anonymous":"A2B3","energy":-296.35131249,"energy_per_atom":-7.40878281225,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-284.27931249,"band_gap":1.9018999999999997,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0006383,"is_theoretical":true,"updated_at":"2021-11-28T01:38:07.526000Z","spacegroup":122},{"id":"mp-15670","created_at":"2022-09-04T14:42:54.316908Z","structure_string":"Y5 S7\n1.0\n1.910125 6.441398 0.000000\n-1.910125 6.441398 0.000000\n0.000000 2.929822 11.262587\nY S\n5 7\ndirect\n0.111946 0.111946 0.578828 Y\n0.888054 0.888054 0.421172 Y\n0.300316 0.300316 0.812583 Y\n0.699684 0.699684 0.187417 Y\n0.000000 0.000000 0.000000 Y\n0.259314 0.259314 0.352683 S\n0.740686 0.740686 0.647317 S\n0.958177 0.958177 0.785115 S\n0.041823 0.041823 0.214885 S\n0.659087 0.659087 0.948812 S\n0.500000 0.500000 0.500000 S\n0.340913 0.340913 0.051188 S\n","nsites":12,"nelements":2,"elements":["Y","S"],"chemical_system":"S-Y","density":4.008251035211342,"density_atomic":0.043298332259033144,"volume":277.1469332400555,"volume_molar":13.908482026449475,"formula_full":"Y5 S7","formula_reduced":"Y5S7","formula_anonymous":"A5B7","energy":-89.66457332,"energy_per_atom":-7.472047776666667,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-86.14357332,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.006128,"is_theoretical":false,"updated_at":"2021-11-28T01:35:59.645000Z","spacegroup":12},{"id":"mp-1188645","created_at":"2022-09-04T14:41:24.591268Z","structure_string":"Y8 S12\n1.0\n3.886970 0.000000 0.000000\n0.000000 10.512275 0.000000\n0.000000 0.000000 10.693050\nY S\n8 12\ndirect\n0.250000 0.187466 0.492295 Y\n0.250000 0.312534 0.992295 Y\n0.750000 0.812534 0.507705 Y\n0.750000 0.687466 0.007705 Y\n0.750000 0.495083 0.691863 Y\n0.750000 0.004917 0.191863 Y\n0.250000 0.504917 0.308137 Y\n0.250000 0.995083 0.808137 Y\n0.250000 0.626580 0.545160 S\n0.250000 0.873420 0.045160 S\n0.750000 0.373420 0.454840 S\n0.750000 0.126580 0.954840 S\n0.750000 0.054180 0.619523 S\n0.750000 0.445820 0.119523 S\n0.250000 0.945820 0.380477 S\n0.250000 0.554180 0.880477 S\n0.250000 0.303358 0.729071 S\n0.250000 0.196642 0.229071 S\n0.750000 0.696642 0.270929 S\n0.750000 0.803358 0.770929 S\n","nsites":20,"nelements":2,"elements":["Y","S"],"chemical_system":"S-Y","density":4.165438927530656,"density_atomic":0.04577417186777155,"volume":436.9276206192056,"volume_molar":13.156198166503673,"formula_full":"Y8 S12","formula_reduced":"Y2S3","formula_anonymous":"A2B3","energy":-148.6888115,"energy_per_atom":-7.434440575000001,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-142.6528115,"band_gap":0.6665000000000001,"is_gap_direct":true,"is_magnetic":false,"total_magnetization":0.0025774,"is_theoretical":false,"updated_at":"2021-11-28T01:35:16.937000Z","spacegroup":62},{"id":"mp-1207423","created_at":"2022-09-04T14:47:19.879903Z","structure_string":"Zr18 W8 S2\n1.0\n4.387795 -7.599885 0.000000\n4.387795 7.599885 0.000000\n0.000000 0.000000 8.686157\nZr W S\n18 8 2\ndirect\n0.539078 0.078157 0.250000 Zr\n0.460922 0.921843 0.750000 Zr\n0.921843 0.460922 0.250000 Zr\n0.078157 0.539078 0.750000 Zr\n0.539078 0.460922 0.250000 Zr\n0.460922 0.539078 0.750000 Zr\n0.196866 0.393733 0.049725 Zr\n0.803134 0.606267 0.950275 Zr\n0.606267 0.803134 0.049725 Zr\n0.803134 0.606267 0.549725 Zr\n0.393733 0.196866 0.950275 Zr\n0.196866 0.393733 0.450275 Zr\n0.196866 0.803134 0.049725 Zr\n0.393733 0.196866 0.549725 Zr\n0.803134 0.196866 0.950275 Zr\n0.606267 0.803134 0.450275 Zr\n0.803134 0.196866 0.549725 Zr\n0.196866 0.803134 0.450275 Zr\n0.000000 0.000000 0.000000 W\n0.000000 0.000000 0.500000 W\n0.891322 0.782644 0.250000 W\n0.108678 0.217356 0.750000 W\n0.217356 0.108678 0.250000 W\n0.782644 0.891322 0.750000 W\n0.891322 0.108678 0.250000 W\n0.108678 0.891322 0.750000 W\n0.333333 0.666667 0.250000 S\n0.666667 0.333333 0.750000 S\n","nsites":28,"nelements":3,"elements":["Zr","W","S"],"chemical_system":"S-W-Zr","density":9.10624144976373,"density_atomic":0.04833336268301107,"volume":579.3099930504495,"volume_molar":12.459594006515818,"formula_full":"Zr18 W8 S2","formula_reduced":"Zr9W4S","formula_anonymous":"AB4C9","energy":-274.24525003,"energy_per_atom":-9.794473215357144,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-273.23925003,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0004074,"is_theoretical":true,"updated_at":"2021-11-28T01:38:03.991000Z","spacegroup":194},{"id":"mp-1028441","created_at":"2022-09-04T14:40:58.036488Z","structure_string":"W4 S8\n1.0\n1.595366 -2.763254 0.000000\n1.595366 2.763254 0.000000\n0.000000 0.000000 38.404804\nW S\n4 8\ndirect\n0.333333 0.666667 0.407548 W\n0.333333 0.666667 0.777356 W\n0.666667 0.333333 0.222644 W\n0.666667 0.333333 0.592452 W\n0.333333 0.666667 0.181685 S\n0.333333 0.666667 0.551493 S\n0.666667 0.333333 0.366588 S\n0.666667 0.333333 0.736396 S\n0.333333 0.666667 0.263604 S\n0.333333 0.666667 0.633412 S\n0.666667 0.333333 0.448507 S\n0.666667 0.333333 0.818315 S\n","nsites":12,"nelements":2,"elements":["W","S"],"chemical_system":"S-W","density":4.864201334162776,"density_atomic":0.035439252888774087,"volume":338.6075896594643,"volume_molar":16.992854727780124,"formula_full":"W4 S8","formula_reduced":"WS2","formula_anonymous":"AB2","energy":-98.76225732,"energy_per_atom":-8.23018811,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-94.73825732,"band_gap":1.5799000000000003,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":1.42e-05,"is_theoretical":true,"updated_at":"2021-11-28T01:35:08.885000Z","spacegroup":164},{"id":"mp-224","created_at":"2022-09-04T14:42:38.977769Z","structure_string":"W2 S4\n1.0\n1.595365 -2.763254 0.000000\n1.595365 2.763254 0.000000\n0.000000 0.000000 14.202402\nW S\n2 4\ndirect\n0.333333 0.666667 0.250000 W\n0.666667 0.333333 0.750000 W\n0.333333 0.666667 0.639241 S\n0.666667 0.333333 0.139241 S\n0.333333 0.666667 0.860759 S\n0.666667 0.333333 0.360759 S\n","nsites":6,"nelements":2,"elements":["W","S"],"chemical_system":"S-W","density":6.576662734574941,"density_atomic":0.047915782633798844,"volume":125.21970153040387,"volume_molar":12.568177809021325,"formula_full":"W2 S4","formula_reduced":"WS2","formula_anonymous":"AB2","energy":-49.38451986999999,"energy_per_atom":-8.230753311666666,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-47.37251987,"band_gap":1.5984999999999996,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":1.4e-05,"is_theoretical":false,"updated_at":"2021-11-28T01:35:53.457000Z","spacegroup":194},{"id":"mp-1042100","created_at":"2022-09-04T14:42:57.567549Z","structure_string":"W2 S4\n1.0\n-2.695469 2.695469 4.975960\n2.695469 -2.695469 4.975960\n2.695469 2.695469 -4.975960\nW S\n2 4\ndirect\n0.750000 0.250000 0.500000 W\n0.000000 0.000000 0.000000 W\n0.875000 0.875395 0.500395 S\n0.124605 0.625000 0.999605 S\n0.375000 0.374605 0.499605 S\n0.625395 0.125000 0.000395 S\n","nsites":6,"nelements":2,"elements":["W","S"],"chemical_system":"S-W","density":5.694723998552027,"density_atomic":0.041490215978322094,"volume":144.61240701024295,"volume_molar":14.51460451096823,"formula_full":"W2 S4","formula_reduced":"WS2","formula_anonymous":"AB2","energy":-44.86822346,"energy_per_atom":-7.4780372433333335,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-42.85622346,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":8.05e-05,"is_theoretical":true,"updated_at":"2021-11-28T01:36:00.074000Z","spacegroup":122},{"id":"mp-1025571","created_at":"2022-09-04T14:40:15.479882Z","structure_string":"W3 S6\n1.0\n1.595365 -2.763254 0.000000\n1.595365 2.763254 0.000000\n0.000000 0.000000 31.303603\nW S\n3 6\ndirect\n0.000000 0.000000 0.500000 W\n0.666667 0.333333 0.273151 W\n0.666667 0.333333 0.726849 W\n0.000000 0.000000 0.222900 S\n0.000000 0.000000 0.676598 S\n0.666667 0.333333 0.449749 S\n0.000000 0.000000 0.323402 S\n0.000000 0.000000 0.777100 S\n0.666667 0.333333 0.550251 S\n","nsites":9,"nelements":2,"elements":["W","S"],"chemical_system":"S-W","density":4.475734373524956,"density_atomic":0.03260898787480613,"volume":275.9975266498058,"volume_molar":18.467732832188688,"formula_full":"W3 S6","formula_reduced":"WS2","formula_anonymous":"AB2","energy":-74.07042386,"energy_per_atom":-8.230047095555555,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-71.05242386,"band_gap":1.6345,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":3.04e-05,"is_theoretical":true,"updated_at":"2021-11-28T01:34:48.232000Z","spacegroup":187},{"id":"mp-1004526","created_at":"2022-09-04T14:45:22.396499Z","structure_string":"W2 S2\n1.0\n1.512755 -2.620168 0.000000\n1.512755 2.620168 0.000000\n0.000000 0.000000 8.180800\nW S\n2 2\ndirect\n0.666667 0.333333 0.536287 W\n0.333333 0.666667 0.036287 W\n0.666667 0.333333 0.840713 S\n0.333333 0.666667 0.340713 S\n","nsites":4,"nelements":2,"elements":["W","S"],"chemical_system":"S-W","density":11.0565156938623,"density_atomic":0.06167888084722244,"volume":64.85201976845094,"volume_molar":9.763699790397855,"formula_full":"W2 S2","formula_reduced":"WS","formula_anonymous":"AB","energy":-35.9262285,"energy_per_atom":-8.981557125,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-34.9202285,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0003956,"is_theoretical":true,"updated_at":"2021-11-28T01:37:04.749000Z","spacegroup":186},{"id":"mp-1207867","created_at":"2022-09-04T14:47:57.613996Z","structure_string":"W21 S8\n1.0\n0.000000 0.000000 3.120560\n-8.362406 8.362406 1.560280\n-8.362406 -8.362406 1.560280\nW S\n21 8\ndirect\n0.344418 0.097318 0.213846 W\n0.655582 0.902682 0.786154 W\n0.558264 0.786154 0.097318 W\n0.441736 0.213846 0.902682 W\n0.013961 0.264737 0.707341 W\n0.986039 0.735263 0.292659 W\n0.721302 0.292659 0.264737 W\n0.278698 0.707341 0.735263 W\n0.192100 0.005585 0.610215 W\n0.807900 0.994415 0.389785 W\n0.802315 0.389785 0.005585 W\n0.197685 0.610215 0.994415 W\n0.450652 0.627915 0.470780 W\n0.549348 0.372085 0.529219 W\n0.921433 0.529219 0.627915 W\n0.078567 0.470780 0.372085 W\n0.187712 0.191830 0.432745 W\n0.812288 0.808170 0.567255 W\n0.620458 0.567255 0.191830 W\n0.379542 0.432745 0.808170 W\n0.000000 0.000000 0.000000 W\n0.060033 0.074578 0.805356 S\n0.939967 0.925422 0.194644 S\n0.865389 0.194644 0.074578 S\n0.134611 0.805356 0.925422 S\n0.372822 0.841598 0.412758 S\n0.627178 0.158402 0.587242 S\n0.785580 0.587242 0.841598 S\n0.214420 0.412758 0.158402 S\n","nsites":29,"nelements":2,"elements":["W","S"],"chemical_system":"S-W","density":15.66469023562215,"density_atomic":0.06644663112937352,"volume":436.4404862533385,"volume_molar":9.063124281311895,"formula_full":"W21 S8","formula_reduced":"W21S8","formula_anonymous":"A8B21","energy":-303.18564636,"energy_per_atom":-10.454677460689656,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-299.16164636,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0004713,"is_theoretical":true,"updated_at":"2021-11-28T01:38:23.616000Z","spacegroup":87},{"id":"mp-1023925","created_at":"2022-09-04T14:47:00.531538Z","structure_string":"W2 S4\n1.0\n1.595366 -2.763254 0.000000\n1.595366 2.763254 0.000000\n0.000000 0.000000 24.202402\nW S\n2 4\ndirect\n0.333333 0.666667 0.646705 W\n0.666667 0.333333 0.353295 W\n0.333333 0.666667 0.288301 S\n0.666667 0.333333 0.581710 S\n0.333333 0.666667 0.418290 S\n0.666667 0.333333 0.711699 S\n","nsites":6,"nelements":2,"elements":["W","S"],"chemical_system":"S-W","density":3.859300801115937,"density_atomic":0.028117819898615903,"volume":213.38780963937214,"volume_molar":21.417523768606397,"formula_full":"W2 S4","formula_reduced":"WS2","formula_anonymous":"AB2","energy":-49.37884235,"energy_per_atom":-8.229807058333334,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-47.36684235,"band_gap":1.697,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0001742,"is_theoretical":true,"updated_at":"2021-11-28T01:37:48.496000Z","spacegroup":164},{"id":"mp-1023937","created_at":"2022-09-04T14:41:16.798065Z","structure_string":"W1 S2\n1.0\n1.595365 -2.763254 0.000000\n1.595365 2.763254 0.000000\n0.000000 0.000000 17.101201\nW S\n1 2\ndirect\n0.333333 0.666667 0.500000 W\n0.666667 0.333333 0.408016 S\n0.666667 0.333333 0.591984 S\n","nsites":3,"nelements":2,"elements":["W","S"],"chemical_system":"S-W","density":2.7309312361995106,"density_atomic":0.019896824998134045,"volume":150.77782511940194,"volume_molar":30.266842878523413,"formula_full":"W1 S2","formula_reduced":"WS2","formula_anonymous":"AB2","energy":-24.68708676,"energy_per_atom":-8.22902892,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-23.68108676,"band_gap":1.8091,"is_gap_direct":true,"is_magnetic":false,"total_magnetization":0.0002263,"is_theoretical":true,"updated_at":"2021-11-28T01:35:08.101000Z","spacegroup":187}]}