{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-nsites&page=540","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-nsites&page=538","results":[{"id":"jvasp-45772","created_at":"2022-09-04T14:38:06.903156Z","updated_at":"2022-09-04T14:38:06.903184Z","structure_string":"Li1 V1 Cr1 P4 O14\n1.0\n4.816677 0.000959 0.017819\n-2.144649 -6.609239 0.021759\n-0.070203 0.046757 -7.963550\nLi V Cr P O\n1 1 1 4 14\ndirect\n0.157958 0.674066 0.632880 Li\n0.779536 0.270018 0.492115 V\n0.213282 0.727059 0.000735 Cr\n0.598043 0.484137 0.823420 P\n0.793226 0.909457 0.218908 P\n0.223059 0.091530 0.722049 P\n0.393250 0.518656 0.313980 P\n0.161973 0.486137 0.451502 O\n0.269511 0.512835 0.138431 O\n0.383333 0.606978 0.812248 O\n0.602683 0.905654 0.064393 O\n0.609008 0.742093 0.353367 O\n0.412449 0.251002 0.857073 O\n0.741441 0.484841 0.650495 O\n0.574421 0.372619 0.330744 O\n0.122717 0.888197 0.808464 O\n0.819308 0.542077 0.964549 O\n0.867424 0.105504 0.322805 O\n0.967565 0.165053 0.667383 O\n0.413663 0.079713 0.570494 O\n0.072183 0.859533 0.181986 O\n","nsites":21,"nelements":5,"elements":["Li","V","Cr","P","O"],"chemical_system":"Cr-Li-O-P-V","density":2.9987475632536675,"density_atomic":0.08284518763929594,"volume":253.48485045906367,"volume_molar":7.26914976186682,"formula_full":"Li1 V1 Cr1 P4 O14","formula_reduced":"LiVCr(P2O7)2","formula_anonymous":"ABCD4E14","energy_above_hull":3.2401325047619047,"spacegroup":1},{"id":"jvasp-43400","created_at":"2022-09-04T14:38:10.483001Z","updated_at":"2022-09-04T14:38:10.483026Z","structure_string":"Ba2 Ti6 N2 O11\n1.0\n0.000000 3.945926 0.000000\n-7.606817 1.972964 -0.046175\n-1.457953 -0.000000 9.120372\nBa Ti N O\n2 6 2 11\ndirect\n0.545789 0.908420 0.764980 Ba\n0.454211 0.091580 0.235020 Ba\n0.121789 0.756420 0.087487 Ti\n0.172151 0.655697 0.441575 Ti\n0.242663 0.514672 0.757378 Ti\n0.757337 0.485328 0.242621 Ti\n0.827849 0.344303 0.558424 Ti\n0.878211 0.243580 0.912513 Ti\n0.703276 0.593448 0.420831 N\n0.296724 0.406552 0.579169 N\n0.873343 0.253314 0.382618 O\n0.837398 0.325206 0.090474 O\n0.362330 0.275341 0.890603 O\n0.243075 0.513851 0.230334 O\n0.074840 0.850318 0.288370 O\n0.637670 0.724659 0.109396 O\n0.162602 0.674795 0.909526 O\n0.126657 0.746686 0.617381 O\n0.925160 0.149682 0.711629 O\n0.756925 0.486149 0.769665 O\n0.000000 0.000000 0.000000 O\n","nsites":21,"nelements":4,"elements":["Ba","Ti","N","O"],"chemical_system":"Ba-N-O-Ti","density":4.641030212070092,"density_atomic":0.0766361392120499,"volume":274.0221547681784,"volume_molar":7.858095177964168,"formula_full":"Ba2 Ti6 N2 O11","formula_reduced":"Ba2Ti6N2O11","formula_anonymous":"A2B2C6D11","energy_above_hull":3.43630414,"spacegroup":12},{"id":"jvasp-21638","created_at":"2022-09-04T14:38:28.865975Z","updated_at":"2022-09-04T14:38:28.865994Z","structure_string":"Mg2 Co12 P7\n1.0\n4.495139 -7.785808 -0.000000\n4.495139 7.785808 -0.000000\n0.000000 0.000000 3.473781\nMg Co P\n2 12 7\ndirect\n0.333333 0.666667 0.000000 Mg\n0.666667 0.333333 0.500000 Mg\n0.557286 0.939270 0.500000 Co\n0.443024 0.066398 0.000000 Co\n0.623374 0.556976 0.000000 Co\n0.153327 0.273748 0.000000 Co\n0.120421 0.846673 0.000000 Co\n0.933602 0.376626 0.000000 Co\n0.894406 0.135188 0.500000 Co\n0.864812 0.759217 0.500000 Co\n0.240783 0.105595 0.500000 Co\n0.060730 0.618016 0.500000 Co\n0.381984 0.442714 0.500000 Co\n0.726252 0.879580 0.000000 Co\n0.407280 0.290767 0.000000 P\n0.593763 0.708039 0.500000 P\n0.291961 0.885724 0.500000 P\n0.114276 0.406237 0.500000 P\n0.709233 0.116513 0.000000 P\n0.883487 0.592720 0.000000 P\n0.000000 0.000000 0.000000 P\n","nsites":21,"nelements":3,"elements":["Mg","Co","P"],"chemical_system":"Co-Mg-P","density":6.642248719491447,"density_atomic":0.08636545160030994,"volume":243.15278402277974,"volume_molar":6.972858531290757,"formula_full":"Mg2 Co12 P7","formula_reduced":"Mg2Co12P7","formula_anonymous":"A2B7C12","energy_above_hull":3.506074161904762,"spacegroup":174},{"id":"jvasp-21914","created_at":"2022-09-04T14:38:17.051264Z","updated_at":"2022-09-04T14:38:17.051291Z","structure_string":"Sc5 Si7 Pt9\n1.0\n5.024435 -8.702577 0.000000\n5.024435 8.702577 -0.000000\n-0.000000 -0.000000 3.913793\nSc Si Pt\n5 7 9\ndirect\n0.333333 0.666668 0.000000 Sc\n0.666668 0.333333 0.500000 Sc\n0.229873 0.125143 0.500000 Sc\n0.895270 0.770128 0.500000 Sc\n0.874858 0.104731 0.500000 Sc\n0.000000 0.000000 0.000000 Si\n0.683358 0.572121 0.000000 Si\n0.888764 0.316643 0.000000 Si\n0.427880 0.111237 0.000000 Si\n0.144678 0.717363 0.500000 Si\n0.572687 0.855323 0.500000 Si\n0.282637 0.427314 0.500000 Si\n0.159700 0.876078 0.000000 Pt\n0.549476 0.602062 0.500000 Pt\n0.397939 0.947414 0.500000 Pt\n0.052587 0.450524 0.500000 Pt\n0.651916 0.086289 0.000000 Pt\n0.913712 0.565627 0.000000 Pt\n0.434374 0.348085 0.000000 Pt\n0.716379 0.840301 0.000000 Pt\n0.123923 0.283622 0.000000 Pt\n","nsites":21,"nelements":3,"elements":["Sc","Si","Pt"],"chemical_system":"Pt-Sc-Si","density":10.562611707552248,"density_atomic":0.06135590129345546,"volume":342.26536579685074,"volume_molar":9.81509623857869,"formula_full":"Sc5 Si7 Pt9","formula_reduced":"Sc5Si7Pt9","formula_anonymous":"A5B7C9","energy_above_hull":3.485015669047619,"spacegroup":174},{"id":"jvasp-29949","created_at":"2022-09-04T14:38:16.961723Z","updated_at":"2022-09-04T14:38:16.961742Z","structure_string":"Sn3 P4 O14\n1.0\n5.528216 0.024170 0.439559\n2.929194 6.522867 -0.179817\n0.313431 0.910077 9.006561\nSn P O\n3 4 14\ndirect\n0.762267 0.396010 0.327977 Sn\n0.237733 0.603991 0.672023 Sn\n0.000000 0.000000 0.000000 Sn\n0.654555 0.692104 0.958133 P\n0.884080 0.347121 0.715441 P\n0.115920 0.652880 0.284558 P\n0.345444 0.307896 0.041867 P\n0.863700 0.652861 0.370239 O\n0.348635 0.410320 0.891407 O\n0.651365 0.589681 0.108592 O\n0.136299 0.347140 0.629761 O\n0.658774 0.408897 0.613018 O\n0.829140 0.814254 0.934753 O\n0.797265 0.521108 0.834911 O\n0.074644 0.858002 0.202995 O\n0.202734 0.478893 0.165089 O\n0.170859 0.185747 0.065247 O\n0.624788 0.183693 0.095710 O\n0.925356 0.141999 0.797005 O\n0.341226 0.591104 0.386981 O\n0.375212 0.816307 0.904290 O\n","nsites":21,"nelements":3,"elements":["Sn","P","O"],"chemical_system":"O-P-Sn","density":3.5935992771856293,"density_atomic":0.06455307211488294,"volume":325.3137195798676,"volume_molar":9.328976240329196,"formula_full":"Sn3 P4 O14","formula_reduced":"Sn3(P2O7)2","formula_anonymous":"A3B4C14","energy_above_hull":2.735245528571429,"spacegroup":2},{"id":"jvasp-55293","created_at":"2022-09-04T14:38:10.475686Z","updated_at":"2022-09-04T14:38:10.475733Z","structure_string":"Ba2 Co1 B6 O12\n1.0\n6.876768 -0.073261 -0.052022\n3.261777 6.056063 -0.049024\n3.261771 1.922193 5.743371\nBa Co B O\n2 1 6 12\ndirect\n0.788024 0.788071 0.788092 Ba\n0.211977 0.211928 0.211909 Ba\n0.000000 0.000000 0.000000 Co\n0.241850 0.635548 0.354749 B\n0.758150 0.364451 0.645252 B\n0.645370 0.758029 0.364450 B\n0.354631 0.241970 0.635551 B\n0.364547 0.645283 0.758060 B\n0.635454 0.354716 0.241941 B\n0.572278 0.195263 0.462864 O\n0.082331 0.842032 0.315088 O\n0.315000 0.082459 0.842039 O\n0.158052 0.684938 0.917574 O\n0.537221 0.427615 0.804720 O\n0.917669 0.157967 0.684913 O\n0.685001 0.917540 0.157962 O\n0.804812 0.537074 0.427558 O\n0.841949 0.315061 0.082427 O\n0.195189 0.462924 0.572443 O\n0.462780 0.572384 0.195281 O\n0.427723 0.804736 0.537137 O\n","nsites":21,"nelements":4,"elements":["Ba","Co","B","O"],"chemical_system":"B-Ba-Co-O","density":4.052773789263444,"density_atomic":0.0868045279826421,"volume":241.92286379576043,"volume_molar":6.937588280192273,"formula_full":"Ba2 Co1 B6 O12","formula_reduced":"Ba2Co(BO2)6","formula_anonymous":"AB2C6D12","energy_above_hull":3.4126033495238093,"spacegroup":148},{"id":"jvasp-51699","created_at":"2022-09-04T14:38:08.855847Z","updated_at":"2022-09-04T14:38:08.855870Z","structure_string":"S3 F18\n1.0\n4.713653 0.017680 0.008593\n0.645613 7.908063 -0.036064\n0.650580 3.795908 6.943445\nS F\n3 18\ndirect\n0.000000 0.000000 0.000000 S\n0.419153 0.668027 0.668208 S\n0.580846 0.331973 0.331793 S\n0.759897 0.131550 0.409778 F\n0.240101 0.868450 0.590223 F\n0.353655 0.252637 0.253015 F\n0.646344 0.747363 0.746986 F\n0.808053 0.411348 0.410596 F\n0.191945 0.588651 0.589405 F\n0.402176 0.254165 0.532245 F\n0.597823 0.745835 0.467755 F\n0.759735 0.409685 0.131432 F\n0.240263 0.590314 0.868569 F\n0.290865 0.930355 0.929328 F\n0.709134 0.069644 0.070673 F\n0.123837 0.205463 0.928638 F\n0.876161 0.794537 0.071363 F\n0.876419 0.073807 0.794194 F\n0.123580 0.926192 0.205806 F\n0.597987 0.467518 0.746269 F\n0.402011 0.532481 0.253732 F\n","nsites":21,"nelements":2,"elements":["S","F"],"chemical_system":"F-S","density":2.8052788013238645,"density_atomic":0.08096685996104527,"volume":259.3653750448456,"volume_molar":7.437784746620245,"formula_full":"S3 F18","formula_reduced":"SF6","formula_anonymous":"AB6","energy_above_hull":0.0,"spacegroup":12},{"id":"jvasp-55691","created_at":"2022-09-04T14:38:10.489188Z","updated_at":"2022-09-04T14:38:10.489207Z","structure_string":"Na4 Mg4 H12\n1.0\n5.342049 0.000000 0.000000\n0.000000 5.429977 0.000000\n0.000000 0.000000 7.627233\nNa Mg H\n4 4 12\ndirect\n0.005798 0.031868 0.250000 Na\n0.494202 0.531869 0.250000 Na\n0.505798 0.468132 0.750000 Na\n0.994202 0.968132 0.750000 Na\n0.000000 0.500000 0.500000 Mg\n0.000000 0.500000 0.000000 Mg\n0.500000 0.000000 0.000000 Mg\n0.500000 0.000000 0.500000 Mg\n0.795542 0.206017 0.543052 H\n0.417377 0.025945 0.750000 H\n0.704459 0.706017 0.956947 H\n0.704459 0.706017 0.543052 H\n0.295541 0.293984 0.043052 H\n0.295541 0.293984 0.456947 H\n0.582623 0.974055 0.250000 H\n0.795542 0.206017 0.956947 H\n0.082623 0.525946 0.750000 H\n0.204459 0.793984 0.043052 H\n0.917377 0.474055 0.250000 H\n0.204459 0.793984 0.456947 H\n","nsites":20,"nelements":3,"elements":["Na","Mg","H"],"chemical_system":"H-Mg-Na","density":1.5106528512056245,"density_atomic":0.09039764670246198,"volume":221.24469750665867,"volume_molar":6.661833553943598,"formula_full":"Na4 Mg4 H12","formula_reduced":"NaMgH3","formula_anonymous":"ABC3","energy_above_hull":1.2475376099999995,"spacegroup":62},{"id":"jvasp-21908","created_at":"2022-09-04T14:38:28.804724Z","updated_at":"2022-09-04T14:38:28.804754Z","structure_string":"Nd4 B4 O12\n1.0\n6.312765 -0.116882 -0.202045\n-1.999625 6.286765 -0.043790\n-1.939403 -1.029451 6.243841\nNd B O\n4 4 12\ndirect\n0.432152 0.808587 0.211284 Nd\n0.567850 0.191414 0.788717 Nd\n0.072852 0.276594 0.358681 Nd\n0.927151 0.723408 0.641320 Nd\n0.505888 0.278268 0.278126 B\n0.494114 0.721733 0.721875 B\n0.969961 0.756834 0.207210 B\n0.030041 0.243168 0.792791 B\n0.382536 0.129745 0.381365 O\n0.617467 0.870257 0.618636 O\n0.989707 0.242451 0.983218 O\n0.010296 0.757550 0.016782 O\n0.628445 0.200590 0.170295 O\n0.493269 0.480704 0.285658 O\n0.852025 0.874479 0.277825 O\n0.147978 0.125523 0.722175 O\n0.914466 0.351780 0.643625 O\n0.506734 0.519297 0.714343 O\n0.371558 0.799411 0.829705 O\n0.085536 0.648221 0.356375 O\n","nsites":20,"nelements":3,"elements":["Nd","B","O"],"chemical_system":"B-Nd-O","density":5.546423080483463,"density_atomic":0.08224856715135645,"volume":243.16533032357097,"volume_molar":7.321879235802204,"formula_full":"Nd4 B4 O12","formula_reduced":"NdBO3","formula_anonymous":"ABC3","energy_above_hull":2.1913909166666663,"spacegroup":2},{"id":"jvasp-14327","created_at":"2022-09-04T14:38:11.956768Z","updated_at":"2022-09-04T14:38:11.956790Z","structure_string":"Nb4 Se4 Br12\n1.0\n0.000000 6.611502 0.091927\n6.941678 0.000000 0.000000\n0.000000 -1.845256 -12.506862\nNb Se Br\n4 4 12\ndirect\n0.071686 0.642251 0.149592 Nb\n0.928313 0.642251 0.350408 Nb\n0.928313 0.357750 0.850407 Nb\n0.071686 0.357750 0.649592 Nb\n0.166040 0.083597 0.800281 Se\n0.166041 0.916403 0.300281 Se\n0.833959 0.916403 0.199719 Se\n0.833958 0.083597 0.699719 Se\n0.158275 0.687862 0.543843 Br\n0.158275 0.312138 0.043843 Br\n0.257237 0.564961 0.807333 Br\n0.742762 0.564961 0.692667 Br\n0.742762 0.435039 0.192667 Br\n0.634368 0.798883 0.426649 Br\n0.365631 0.201118 0.573350 Br\n0.634368 0.201118 0.926649 Br\n0.841724 0.687862 0.956157 Br\n0.365631 0.798883 0.073351 Br\n0.257237 0.435039 0.307333 Br\n0.841724 0.312138 0.456157 Br\n","nsites":20,"nelements":3,"elements":["Nb","Se","Br"],"chemical_system":"Br-Nb-Se","density":4.772440414805194,"density_atomic":0.03491474449727133,"volume":572.8238968371384,"volume_molar":17.24813068722483,"formula_full":"Nb4 Se4 Br12","formula_reduced":"NbSeBr3","formula_anonymous":"ABC3","energy_above_hull":1.241269016333333,"spacegroup":13},{"id":"jvasp-59082","created_at":"2022-09-04T14:38:10.695838Z","updated_at":"2022-09-04T14:38:10.695848Z","structure_string":"Ge4 Cl16\n1.0\n0.000000 9.506950 -0.059635\n6.367800 0.000000 0.000000\n0.000000 -2.070879 -9.354809\nGe Cl\n4 16\ndirect\n0.252400 0.076767 0.135118 Ge\n0.747600 0.576767 0.364882 Ge\n0.747600 0.923233 0.864882 Ge\n0.252400 0.423233 0.635118 Ge\n0.924004 0.082180 0.803850 Cl\n0.075996 0.582180 0.696150 Cl\n0.433804 0.073857 0.310823 Cl\n0.566195 0.573857 0.189177 Cl\n0.566195 0.926143 0.689177 Cl\n0.433804 0.426143 0.810823 Cl\n0.306838 0.918023 0.956863 Cl\n0.693162 0.081977 0.043137 Cl\n0.924004 0.417820 0.303850 Cl\n0.306838 0.581977 0.456863 Cl\n0.190438 0.106299 0.577599 Cl\n0.809562 0.606299 0.922400 Cl\n0.809562 0.893701 0.422400 Cl\n0.190438 0.393701 0.077599 Cl\n0.693162 0.418023 0.543137 Cl\n0.075996 0.917821 0.196150 Cl\n","nsites":20,"nelements":2,"elements":["Ge","Cl"],"chemical_system":"Cl-Ge","density":2.5117186697635834,"density_atomic":0.035266454460819795,"volume":567.1111628819828,"volume_molar":17.07611624721294,"formula_full":"Ge4 Cl16","formula_reduced":"GeCl4","formula_anonymous":"AB4","energy_above_hull":0.0787624439999999,"spacegroup":14},{"id":"jvasp-27483","created_at":"2022-09-04T14:38:15.990276Z","updated_at":"2022-09-04T14:38:15.990305Z","structure_string":"Ca2 Zn2 Si4 O12\n1.0\n5.188176 -0.008054 1.054569\n1.237006 6.544896 0.614301\n-0.007874 0.027170 6.688977\nCa Zn Si O\n2 2 4 12\ndirect\n0.250001 0.699909 0.300092 Ca\n0.750001 0.300093 0.699908 Ca\n0.250001 0.094268 0.905732 Zn\n0.750001 0.905733 0.094268 Zn\n0.770681 0.379988 0.193308 Si\n0.729321 0.806693 0.620013 Si\n0.229321 0.620013 0.806692 Si\n0.270681 0.193308 0.379987 Si\n0.355520 0.026532 0.206815 O\n0.144481 0.793186 0.973468 O\n0.509226 0.329224 0.371692 O\n0.673498 0.610534 0.111169 O\n0.826504 0.888832 0.389467 O\n0.326504 0.389467 0.888831 O\n0.173498 0.111169 0.610533 O\n0.009226 0.371692 0.329224 O\n0.490776 0.670777 0.628308 O\n0.990776 0.628309 0.670777 O\n0.855521 0.206815 0.026532 O\n0.644482 0.973469 0.793185 O\n","nsites":20,"nelements":4,"elements":["Ca","Zn","Si","O"],"chemical_system":"Ca-O-Si-Zn","density":3.7662219807438833,"density_atomic":0.08802767936151545,"volume":227.2012637963933,"volume_molar":6.841189957158862,"formula_full":"Ca2 Zn2 Si4 O12","formula_reduced":"CaZn(SiO3)2","formula_anonymous":"ABC2D6","energy_above_hull":1.961378902,"spacegroup":15}]}