{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-volume_molar&page=3597","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-volume_molar&page=3595","results":[{"id":"jvasp-36423","created_at":"2022-09-04T14:37:28.641933Z","updated_at":"2022-09-04T14:37:28.641954Z","structure_string":"Zr1 N1\n1.0\n1.570357 -2.719939 0.000000\n1.570357 2.719939 -0.000000\n0.000000 0.000000 2.923594\nZr N\n1 1\ndirect\n0.000000 0.000000 0.000000 Zr\n0.333334 0.666668 0.499999 N\n","nsites":2,"nelements":2,"elements":["Zr","N"],"chemical_system":"N-Zr","density":6.996598300328787,"density_atomic":0.0800802424013477,"volume":24.97494937610655,"volume_molar":7.520133030839392,"formula_full":"Zr1 N1","formula_reduced":"ZrN","formula_anonymous":"AB","energy_above_hull":2.370683875,"spacegroup":187},{"id":"jvasp-23432","created_at":"2022-09-04T14:38:14.631998Z","updated_at":"2022-09-04T14:38:14.632026Z","structure_string":"Mg8 Bi4 P4 O24\n1.0\n5.327559 -0.000000 0.000000\n-0.000000 7.852421 0.000000\n0.000000 0.000000 11.939782\nMg Bi P O\n8 4 4 24\ndirect\n0.750000 0.810629 0.599115 Mg\n0.750000 0.296996 0.093230 Mg\n0.750000 0.203004 0.593230 Mg\n0.250000 0.310630 0.900885 Mg\n0.250000 0.796996 0.406770 Mg\n0.250000 0.703004 0.906770 Mg\n0.250000 0.189370 0.400885 Mg\n0.750000 0.689370 0.099115 Mg\n0.250000 0.489293 0.599047 Bi\n0.250000 0.010707 0.099047 Bi\n0.750000 0.510707 0.400952 Bi\n0.750000 0.989293 0.900952 Bi\n0.750000 0.979147 0.301740 P\n0.250000 0.479147 0.198260 P\n0.250000 0.020853 0.698260 P\n0.750000 0.520853 0.801740 P\n0.750000 0.378591 0.713506 O\n0.992832 0.993239 0.374956 O\n0.492832 0.006761 0.625044 O\n0.498104 0.174166 0.994170 O\n0.750000 0.698807 0.747351 O\n0.250000 0.198807 0.752649 O\n0.507168 0.993239 0.374956 O\n0.001896 0.174166 0.994170 O\n0.007168 0.493239 0.125044 O\n0.998104 0.674166 0.505830 O\n0.998104 0.825834 0.005830 O\n0.007168 0.006761 0.625044 O\n0.250000 0.621409 0.286494 O\n0.250000 0.301193 0.252649 O\n0.750000 0.121409 0.213506 O\n0.750000 0.801193 0.247351 O\n0.250000 0.878591 0.786494 O\n0.992832 0.506761 0.874956 O\n0.507168 0.506761 0.874956 O\n0.001896 0.325834 0.494170 O\n0.501897 0.674166 0.505830 O\n0.498104 0.325834 0.494170 O\n0.492832 0.493239 0.125044 O\n0.501897 0.825834 0.005830 O\n","nsites":40,"nelements":4,"elements":["Mg","Bi","P","O"],"chemical_system":"Bi-Mg-O-P","density":5.113821813652732,"density_atomic":0.08008141717355233,"volume":499.49166001036247,"volume_molar":7.520022712571164,"formula_full":"Mg8 Bi4 P4 O24","formula_reduced":"Mg2BiPO6","formula_anonymous":"ABC2D6","energy_above_hull":1.7447658900000005,"spacegroup":62},{"id":"jvasp-65013","created_at":"2022-09-04T14:35:53.956260Z","updated_at":"2022-09-04T14:35:53.956282Z","structure_string":"Be1 Cu1 Pt1\n1.0\n1.366576 -2.366978 0.000000\n1.366576 2.366978 -0.000000\n-0.000000 -0.000000 5.790526\nBe Cu Pt\n1 1 1\ndirect\n0.000000 0.000000 -0.000254 Be\n0.333334 0.666669 0.302819 Cu\n0.666669 0.333334 0.697434 Pt\n","nsites":3,"nelements":3,"elements":["Be","Cu","Pt"],"chemical_system":"Be-Cu-Pt","density":11.863904360525298,"density_atomic":0.08008390326934867,"volume":37.46071154786259,"volume_molar":7.519789263699533,"formula_full":"Be1 Cu1 Pt1","formula_reduced":"BeCuPt","formula_anonymous":"ABC","energy_above_hull":1.1306159833333331,"spacegroup":156},{"id":"jvasp-121010","created_at":"2022-09-04T14:38:54.537701Z","updated_at":"2022-09-04T14:38:54.537727Z","structure_string":"P1 H1 F2\n1.0\n3.163665 -0.000000 0.000000\n-0.000000 3.163665 -0.000000\n0.000000 -0.000000 4.990266\nP H F\n1 1 2\ndirect\n0.499999 0.499999 0.463730 P\n0.000000 0.000000 0.169851 H\n0.000000 0.000000 0.595344 F\n0.499999 0.499999 0.781077 F\n","nsites":4,"nelements":3,"elements":["P","H","F"],"chemical_system":"F-H-P","density":2.326532389828174,"density_atomic":0.08008576266873535,"volume":49.94645573328052,"volume_molar":7.519614672223108,"formula_full":"P1 H1 F2","formula_reduced":"PHF2","formula_anonymous":"ABC2","energy_above_hull":1.22072151625,"spacegroup":99},{"id":"jvasp-101155","created_at":"2022-09-04T14:36:42.824544Z","updated_at":"2022-09-04T14:36:42.824576Z","structure_string":"Mn1 V2 Si6\n1.0\n4.524513 -0.000077 0.000000\n-2.300165 3.896211 0.000000\n0.000000 0.000000 6.374802\nMn V Si\n1 2 6\ndirect\n0.499999 0.500000 -0.000000 Mn\n0.499999 -0.000000 0.669716 V\n-0.000001 0.500000 0.330284 V\n0.165215 0.834783 -0.000000 Si\n0.166197 0.329841 0.668233 Si\n0.670157 0.833802 0.331766 Si\n0.834782 0.165216 -0.000000 Si\n0.833801 0.670158 0.668233 Si\n0.329841 0.166197 0.331766 Si\n","nsites":9,"nelements":3,"elements":["Mn","V","Si"],"chemical_system":"Mn-Si-V","density":4.807308190072507,"density_atomic":0.0800877078406899,"volume":112.37679592357367,"volume_molar":7.51943203566172,"formula_full":"Mn1 V2 Si6","formula_reduced":"Mn(VSi3)2","formula_anonymous":"AB2C6","energy_above_hull":4.142886360153257,"spacegroup":21},{"id":"jvasp-97311","created_at":"2022-09-04T14:36:16.155515Z","updated_at":"2022-09-04T14:36:16.155549Z","structure_string":"Li4 B4 S8 O32\n1.0\n7.596727 0.000000 -0.354700\n0.000000 9.245400 0.000000\n-0.011403 0.000000 8.533832\nLi B S O\n4 4 8 32\ndirect\n0.237822 0.119106 0.534015 Li\n0.237822 0.880894 0.034015 Li\n0.720360 0.673448 0.869158 Li\n0.720360 0.326552 0.369158 Li\n0.217297 0.404235 0.019393 B\n0.217298 0.595765 0.519393 B\n0.733496 0.851086 0.397229 B\n0.733496 0.148914 0.897229 B\n0.087213 0.835614 0.371920 S\n0.643458 0.946717 0.101695 S\n0.643459 0.053283 0.601695 S\n0.087213 0.164386 0.871920 S\n0.119812 0.379987 0.320377 S\n0.573817 0.618283 0.516878 S\n0.573817 0.381717 0.016878 S\n0.119812 0.620013 0.820377 S\n0.391864 0.560213 0.462052 O\n0.590336 0.256032 0.896653 O\n0.590336 0.743968 0.396653 O\n0.211710 0.451301 0.182925 O\n0.211711 0.548699 0.682925 O\n0.086399 0.513750 0.423004 O\n0.683265 0.962757 0.279659 O\n0.683265 0.037243 0.779659 O\n0.759008 0.926212 0.548719 O\n0.759007 0.073788 0.048719 O\n0.177510 0.247516 0.011211 O\n0.177510 0.752484 0.511211 O\n0.391864 0.439787 0.962052 O\n0.086399 0.486250 0.923004 O\n0.166237 0.204077 0.728098 O\n0.949038 0.675870 0.771571 O\n0.087836 0.013921 0.914866 O\n0.087836 0.986079 0.414867 O\n0.709577 0.811008 0.045559 O\n0.709577 0.188992 0.545559 O\n0.460252 0.978515 0.066254 O\n0.460252 0.021485 0.566254 O\n0.897217 0.774962 0.363381 O\n0.949038 0.324130 0.271571 O\n0.242105 0.718160 0.898596 O\n0.242104 0.281840 0.398596 O\n0.699968 0.507016 0.487550 O\n0.699968 0.492984 0.987550 O\n0.571272 0.675258 0.674163 O\n0.571272 0.324742 0.174163 O\n0.166236 0.795923 0.228098 O\n0.897217 0.225038 0.863381 O\n","nsites":48,"nelements":4,"elements":["Li","B","S","O"],"chemical_system":"B-Li-O-S","density":2.3259754812284514,"density_atomic":0.08008884294496277,"volume":599.3344170671277,"volume_molar":7.519325462272477,"formula_full":"Li4 B4 S8 O32","formula_reduced":"LiB(SO4)2","formula_anonymous":"ABC2D8","energy_above_hull":2.7285917152777777,"spacegroup":7},{"id":"jvasp-42256","created_at":"2022-09-04T14:36:21.825597Z","updated_at":"2022-09-04T14:36:21.825623Z","structure_string":"Nb1 V1 O4\n1.0\n5.609723 0.242224 -0.000000\n2.672886 4.937949 0.000000\n-4.141304 -2.590087 2.769244\nNb V O\n1 1 4\ndirect\n0.000000 0.000000 0.000000 Nb\n0.750000 0.249999 0.499999 V\n0.541646 0.041645 0.499999 O\n0.209328 0.209327 0.000000 O\n0.958354 0.458353 0.499999 O\n0.790673 0.790672 0.000000 O\n","nsites":6,"nelements":3,"elements":["Nb","V","O"],"chemical_system":"Nb-O-V","density":4.606929837710771,"density_atomic":0.08008905451412986,"volume":74.91660422762813,"volume_molar":7.5193055986664605,"formula_full":"Nb1 V1 O4","formula_reduced":"NbVO4","formula_anonymous":"ABC4","energy_above_hull":3.1755146000000005,"spacegroup":119},{"id":"jvasp-21843","created_at":"2022-09-04T14:37:37.661636Z","updated_at":"2022-09-04T14:37:37.661665Z","structure_string":"Tb2 Ni8 B2\n1.0\n2.490615 -4.313871 -0.000000\n2.490615 4.313871 0.000000\n-0.000000 0.000000 6.972717\nTb Ni B\n2 8 2\ndirect\n0.000000 0.000000 0.500000 Tb\n0.000000 0.000000 0.000000 Tb\n0.333334 0.666668 0.000000 Ni\n0.666668 0.333334 0.000000 Ni\n0.000001 0.500000 0.708250 Ni\n0.500001 0.500001 0.708250 Ni\n0.500000 0.000001 0.708250 Ni\n0.000001 0.500000 0.291751 Ni\n0.500001 0.500001 0.291751 Ni\n0.500000 0.000001 0.291751 Ni\n0.666668 0.333334 0.500000 B\n0.333334 0.666668 0.500000 B\n","nsites":12,"nelements":3,"elements":["Tb","Ni","B"],"chemical_system":"B-Ni-Tb","density":8.96607802417128,"density_atomic":0.08008947707520418,"volume":149.8324179184236,"volume_molar":7.519265925965777,"formula_full":"Tb2 Ni8 B2","formula_reduced":"TbNi4B","formula_anonymous":"ABC4","energy_above_hull":1.774051763888889,"spacegroup":191},{"id":"jvasp-67220","created_at":"2022-09-04T14:36:07.380668Z","updated_at":"2022-09-04T14:36:07.380689Z","structure_string":"Be2 Nb1 Pt1\n1.0\n2.795415 -0.000000 0.000000\n0.000000 2.795415 0.000000\n-0.000000 0.000000 6.391264\nBe Nb Pt\n2 1 1\ndirect\n0.000000 0.000000 0.021060 Be\n0.500001 0.500001 0.198106 Be\n0.000000 0.000000 0.471535 Nb\n0.500001 0.500001 0.809299 Pt\n","nsites":4,"nelements":3,"elements":["Be","Nb","Pt"],"chemical_system":"Be-Nb-Pt","density":10.174477355293103,"density_atomic":0.0800904348768005,"volume":49.94354202412585,"volume_molar":7.51917600305653,"formula_full":"Be2 Nb1 Pt1","formula_reduced":"Be2NbPt","formula_anonymous":"ABC2","energy_above_hull":2.8469982500000004,"spacegroup":99},{"id":"jvasp-61919","created_at":"2022-09-04T14:35:47.626927Z","updated_at":"2022-09-04T14:35:47.626954Z","structure_string":"Sr2 Cu4 B4 O12\n1.0\n-4.549308 4.549308 3.318005\n4.549308 -4.549308 3.318005\n4.549308 4.549308 -3.318005\nSr Cu B O\n2 4 4 12\ndirect\n0.500000 0.000000 0.500000 Sr\n0.000000 0.500000 0.500000 Sr\n0.853236 0.853236 0.228162 Cu\n0.625074 0.625074 0.771839 Cu\n0.146765 0.374927 0.000000 Cu\n0.374927 0.146765 0.000000 Cu\n0.950209 0.542248 0.000000 B\n0.457753 0.457753 0.407961 B\n0.542248 0.950209 0.000000 B\n0.049792 0.049792 0.592040 B\n0.831785 0.635456 0.000000 O\n0.635456 0.831785 0.000000 O\n0.168216 0.168216 0.803671 O\n0.923820 0.398687 0.818742 O\n0.579945 0.105078 0.181258 O\n0.601314 0.420056 0.525133 O\n0.894923 0.076181 0.474868 O\n0.076181 0.894923 0.474868 O\n0.420056 0.601314 0.525133 O\n0.398687 0.923820 0.818742 O\n0.105078 0.579945 0.181258 O\n0.364545 0.364545 0.196329 O\n","nsites":22,"nelements":4,"elements":["Sr","Cu","B","O"],"chemical_system":"B-Cu-O-Sr","density":4.018106601859226,"density_atomic":0.0800930757727493,"volume":274.6804238411485,"volume_molar":7.518928074490257,"formula_full":"Sr2 Cu4 B4 O12","formula_reduced":"SrCu2(BO3)2","formula_anonymous":"AB2C2D6","energy_above_hull":2.2343203069696966,"spacegroup":121},{"id":"jvasp-85708","created_at":"2022-09-04T14:35:57.460112Z","updated_at":"2022-09-04T14:35:57.460129Z","structure_string":"K2 Co1 H4 Se2 O10\n1.0\n6.261451 0.017278 -1.757193\n-3.018478 6.748693 -0.859881\n0.061568 -0.002146 5.590242\nK Co H Se O\n2 1 4 2 10\ndirect\n0.678845 0.261918 0.272684 K\n0.321155 0.738081 0.727316 K\n0.000000 0.000000 0.000000 Co\n0.845840 0.607985 0.851348 H\n0.154160 0.392015 0.148652 H\n0.991526 0.689086 0.140624 H\n0.008473 0.310913 0.859376 H\n0.697404 0.774652 0.366992 Se\n0.302596 0.225348 0.633008 Se\n0.577648 0.388518 0.732082 O\n0.422352 0.611482 0.267918 O\n0.116359 0.335239 0.600187 O\n0.883640 0.664760 0.399813 O\n0.729053 0.913590 0.147347 O\n0.746183 0.927102 0.644911 O\n0.270946 0.086409 0.852653 O\n-0.004714 0.711613 0.969130 O\n0.253816 0.072897 0.355089 O\n0.004713 0.288386 0.030869 O\n","nsites":19,"nelements":5,"elements":["K","Co","H","Se","O"],"chemical_system":"Co-H-K-O-Se","density":3.213493256527331,"density_atomic":0.08009358412632427,"volume":237.2224967487164,"volume_molar":7.518880351891645,"formula_full":"K2 Co1 H4 Se2 O10","formula_reduced":"K2CoH4(SeO5)2","formula_anonymous":"AB2C2D4E10","energy_above_hull":2.503645717543859,"spacegroup":2},{"id":"jvasp-40481","created_at":"2022-09-04T14:37:54.870321Z","updated_at":"2022-09-04T14:37:54.870341Z","structure_string":"Li1 Ag1 F4\n1.0\n3.526899 -0.012674 -0.012841\n0.505201 4.607109 -0.028836\n0.500279 0.205638 4.605473\nLi Ag F\n1 1 4\ndirect\n0.000000 0.000000 0.000000 Li\n0.500000 0.500001 0.499999 Ag\n0.943573 0.288752 0.290918 F\n0.500318 0.803968 0.194163 F\n0.499683 0.196033 0.805836 F\n0.056428 0.711250 0.709081 F\n","nsites":6,"nelements":3,"elements":["Li","Ag","F"],"chemical_system":"Ag-F-Li","density":4.229419571285332,"density_atomic":0.08009366201601742,"volume":74.91229454335723,"volume_molar":7.518873039911287,"formula_full":"Li1 Ag1 F4","formula_reduced":"LiAgF4","formula_anonymous":"ABC4","energy_above_hull":0.0012866666666666,"spacegroup":12}]}