{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-formula_anonymous&page=3479","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-formula_anonymous&page=3477","results":[{"id":"jvasp-44569","created_at":"2022-09-04T14:37:30.928382Z","updated_at":"2022-09-04T14:37:30.928408Z","structure_string":"Li2 Mg1 Cu2 Si4 O12\n1.0\n5.234538 0.029784 -0.003597\n0.741723 5.701410 0.025720\n1.293021 0.601136 7.367845\nLi Mg Cu Si O\n2 1 2 4 12\ndirect\n0.918230 0.756796 0.413585 Li\n0.081769 0.243204 0.586416 Li\n0.000000 0.000000 0.000000 Mg\n0.494240 0.835232 0.183604 Cu\n0.505759 0.164768 0.816396 Cu\n0.304037 0.774445 0.626587 Si\n0.784539 0.585960 0.815878 Si\n0.215460 0.414040 0.184123 Si\n0.695963 0.225555 0.373414 Si\n0.401406 0.355704 0.348542 O\n0.761480 0.319671 0.907958 O\n0.914105 0.420059 0.306862 O\n0.085894 0.579941 0.693138 O\n0.238520 0.680329 0.092042 O\n0.770930 -0.000316 0.249971 O\n0.269600 0.859616 0.418872 O\n0.737172 0.797301 0.949363 O\n0.730400 0.140384 0.581128 O\n0.229070 0.000316 0.750029 O\n0.598594 0.644296 0.651458 O\n0.262827 0.202699 0.050637 O\n","nsites":21,"nelements":5,"elements":["Li","Mg","Cu","Si","O"],"chemical_system":"Cu-Li-Mg-O-Si","density":3.5499252745786625,"density_atomic":0.09559794530442375,"volume":219.66999325275492,"volume_molar":6.299445810077812,"formula_full":"Li2 Mg1 Cu2 Si4 O12","formula_reduced":"Li2MgCu2(SiO3)4","formula_anonymous":"AB2C2D4E12","energy_above_hull":2.3679603023809523,"spacegroup":2},{"id":"jvasp-98262","created_at":"2022-09-04T14:35:52.126431Z","updated_at":"2022-09-04T14:35:52.126452Z","structure_string":"Ba4 Tl2 Cu2 Hg1 O10\n1.0\n3.877537 -0.000000 -0.353030\n-0.032141 3.877404 -0.353030\n0.026976 0.027200 21.767455\nBa Tl Cu Hg O\n4 2 2 1 10\ndirect\n0.341826 0.341825 0.683650 Ba\n0.568382 0.568380 0.136762 Ba\n0.431621 0.431619 0.863238 Ba\n0.658176 0.658174 0.316350 Ba\n0.223567 0.223566 0.447133 Tl\n0.776435 0.776433 0.552868 Tl\n0.113623 0.113622 0.227245 Cu\n0.886380 0.886377 0.772756 Cu\n0.000000 0.000000 0.000000 Hg\n0.272100 0.272099 0.544199 O\n0.387271 0.887269 0.774540 O\n0.112731 0.612730 0.225460 O\n0.823811 0.823809 0.647619 O\n0.887272 0.387270 0.774540 O\n0.727902 0.727900 0.455801 O\n0.953316 0.953313 0.906628 O\n0.176191 0.176190 0.352381 O\n0.046686 0.046686 0.093372 O\n0.612731 0.112730 0.225460 O\n","nsites":19,"nelements":5,"elements":["Ba","Tl","Cu","Hg","O"],"chemical_system":"Ba-Cu-Hg-O-Tl","density":7.333967967172406,"density_atomic":0.05804303739629901,"volume":327.34331027982165,"volume_molar":10.37530258604969,"formula_full":"Ba4 Tl2 Cu2 Hg1 O10","formula_reduced":"Ba4Tl2Cu2HgO10","formula_anonymous":"AB2C2D4E10","energy_above_hull":1.1931489252631582,"spacegroup":139},{"id":"jvasp-85723","created_at":"2022-09-04T14:35:49.000096Z","updated_at":"2022-09-04T14:35:49.000123Z","structure_string":"K2 Mg1 Mo2 H4 O10\n1.0\n4.959122 -0.636696 -1.747931\n-2.079829 7.314735 -0.143363\n-1.671764 1.759039 6.807201\nK Mg Mo H O\n2 1 2 4 10\ndirect\n0.540793 0.749055 0.437851 K\n0.459206 0.250944 0.562149 K\n0.000000 0.000000 0.000000 Mg\n0.354945 0.704043 0.887016 Mo\n0.645055 0.295956 0.112984 Mo\n0.168828 0.379839 0.080216 H\n0.831172 0.620160 0.919785 H\n0.888308 0.678169 0.272831 H\n0.111692 0.321830 0.727169 H\n0.829956 0.192238 0.040666 O\n0.170044 0.807760 0.959334 O\n0.184480 0.210503 0.825030 O\n0.815520 0.789495 0.174970 O\n0.530155 0.893736 0.746546 O\n0.616675 0.533354 0.872224 O\n0.469845 0.106263 0.253454 O\n0.020859 0.566204 0.677300 O\n0.383325 0.466644 0.127777 O\n-0.020858 0.433795 0.322700 O\n","nsites":19,"nelements":5,"elements":["K","Mg","Mo","H","O"],"chemical_system":"H-K-Mg-Mo-O","density":3.397729892250386,"density_atomic":0.08480896684786834,"volume":224.03291427995458,"volume_molar":7.10083023508895,"formula_full":"K2 Mg1 Mo2 H4 O10","formula_reduced":"K2MgMo2(H2O5)2","formula_anonymous":"AB2C2D4E10","energy_above_hull":2.795099571052632,"spacegroup":2},{"id":"jvasp-111841","created_at":"2022-09-04T14:38:42.321777Z","updated_at":"2022-09-04T14:38:42.321800Z","structure_string":"Li1 Mn2 P2 H4 O10\n1.0\n4.945232 0.065733 -1.222388\n-1.215496 5.022636 -1.330381\n0.025502 -0.096369 7.532633\nLi Mn P H O\n1 2 2 4 10\ndirect\n0.090104 0.394722 0.920474 Li\n0.989392 0.489936 0.494484 Mn\n0.512276 0.008002 0.002665 Mn\n0.427171 0.588936 0.256399 P\n0.568392 0.424180 0.746629 P\n0.884932 0.936215 0.293593 H\n0.075295 0.124821 0.207118 H\n0.116639 0.023417 0.686326 H\n0.925071 0.855662 0.786537 H\n0.669552 0.729823 0.844941 O\n0.243966 0.346706 0.688911 O\n0.319617 0.286212 0.133877 O\n0.747705 0.662384 0.333977 O\n0.328700 0.738831 0.110788 O\n0.690820 0.280438 0.891007 O\n0.296738 0.650502 0.422202 O\n0.103188 0.878622 0.747141 O\n0.678372 0.339379 0.571255 O\n0.907053 0.103712 0.254526 O\n","nsites":19,"nelements":5,"elements":["Li","Mn","P","H","O"],"chemical_system":"H-Li-Mn-O-P","density":3.0427152812637863,"density_atomic":0.1015633930057236,"volume":187.0752781854113,"volume_molar":5.929440304993181,"formula_full":"Li1 Mn2 P2 H4 O10","formula_reduced":"LiMn2P2(H2O5)2","formula_anonymous":"AB2C2D4E10","energy_above_hull":3.191634762250453,"spacegroup":1},{"id":"jvasp-87944","created_at":"2022-09-04T14:36:20.018611Z","updated_at":"2022-09-04T14:36:20.018629Z","structure_string":"Ca2 Mg1 P2 H4 O10\n1.0\n5.415653 -0.008383 -0.693504\n-2.072962 5.079739 -1.721537\n0.003400 -0.017527 6.812464\nCa Mg P H O\n2 1 2 4 10\ndirect\n0.652189 0.299831 0.761797 Ca\n0.347810 0.700169 0.238202 Ca\n0.000000 0.000000 0.000000 Mg\n0.666204 0.335005 0.245041 P\n0.333796 0.664995 0.754958 P\n0.851128 0.872478 0.601118 H\n0.919151 0.830267 0.316583 H\n0.080849 0.169734 0.683416 H\n0.148872 0.127522 0.398881 H\n0.594045 0.746828 0.930092 O\n0.897593 0.336032 0.130300 O\n0.102407 0.663968 0.869700 O\n0.930311 0.048546 0.722173 O\n0.363317 0.840333 0.622254 O\n0.720302 0.624895 0.385743 O\n0.279698 0.375105 0.614256 O\n0.069689 0.951454 0.277826 O\n0.405955 0.253173 0.069908 O\n0.636683 0.159667 0.377746 O\n","nsites":19,"nelements":5,"elements":["Ca","Mg","P","H","O"],"chemical_system":"Ca-H-Mg-O-P","density":2.932390580041569,"density_atomic":0.10154094906381136,"volume":187.11662807149688,"volume_molar":5.93075090938485,"formula_full":"Ca2 Mg1 P2 H4 O10","formula_reduced":"Ca2MgP2(H2O5)2","formula_anonymous":"AB2C2D4E10","energy_above_hull":2.437388731052631,"spacegroup":2},{"id":"jvasp-40994","created_at":"2022-09-04T14:37:33.453104Z","updated_at":"2022-09-04T14:37:33.453131Z","structure_string":"Sr1 Ni2 P2 H4 O10\n1.0\n-4.481253 -3.011150 -0.006255\n4.481253 -3.011150 0.006255\n-3.037094 0.000000 6.772364\nSr Ni P H O\n1 2 2 4 10\ndirect\n0.000000 0.000000 0.000000 Sr\n0.500000 0.000000 0.499998 Ni\n0.999999 0.500000 0.500000 Ni\n0.586399 0.413601 0.222549 P\n0.413601 0.586399 0.777451 P\n0.255280 0.744720 0.207464 H\n0.073840 0.926160 0.365868 H\n0.926160 0.073840 0.634132 H\n0.744720 0.255280 0.792535 H\n0.299338 0.700661 0.661728 O\n0.814736 0.185263 0.638991 O\n0.185263 0.814737 0.361009 O\n0.700661 0.299339 0.338272 O\n0.703526 0.296474 0.003303 O\n0.265680 0.307247 0.272658 O\n0.296474 0.703526 0.996697 O\n0.307248 0.265680 0.727342 O\n0.692752 0.734320 0.272658 O\n0.734321 0.692753 0.727342 O\n","nsites":19,"nelements":5,"elements":["Sr","Ni","P","H","O"],"chemical_system":"H-Ni-O-P-Sr","density":3.913203121224911,"density_atomic":0.10389142262685175,"volume":182.88324020975784,"volume_molar":5.796571658884493,"formula_full":"Sr1 Ni2 P2 H4 O10","formula_reduced":"SrNi2P2(H2O5)2","formula_anonymous":"AB2C2D4E10","energy_above_hull":2.6844530057894733,"spacegroup":12},{"id":"jvasp-111666","created_at":"2022-09-04T14:38:41.358845Z","updated_at":"2022-09-04T14:38:41.358875Z","structure_string":"K2 Mg1 Mo2 H4 O10\n1.0\n5.849353 -0.016197 -0.676875\n-2.407680 5.567999 -2.294757\n0.008976 0.022888 7.683891\nK Mg Mo H O\n2 1 2 4 10\ndirect\n0.341472 0.711609 0.239495 K\n0.658528 0.288391 0.760506 K\n0.000000 0.000000 0.000000 Mg\n0.325141 0.661574 0.759155 Mo\n0.674859 0.338426 0.240845 Mo\n0.926090 0.863693 0.297022 H\n0.073910 0.136307 0.702978 H\n0.127378 0.131503 0.390950 H\n0.872622 0.868497 0.609050 H\n0.903958 0.298680 0.111869 O\n0.096042 0.701320 0.888131 O\n0.380844 0.230450 0.071552 O\n0.619156 0.769550 0.928448 O\n0.350963 0.812167 0.608902 O\n0.237979 0.347506 0.622232 O\n0.649037 0.187833 0.391098 O\n0.052477 0.983731 0.267314 O\n0.762021 0.652494 0.377768 O\n0.947523 0.016269 0.732686 O\n","nsites":19,"nelements":5,"elements":["K","Mg","Mo","H","O"],"chemical_system":"H-K-Mg-Mo-O","density":3.040712568082623,"density_atomic":0.0758976432966591,"volume":250.33715376029798,"volume_molar":7.9345556705383045,"formula_full":"K2 Mg1 Mo2 H4 O10","formula_reduced":"K2MgMo2(H2O5)2","formula_anonymous":"AB2C2D4E10","energy_above_hull":2.792805360526316,"spacegroup":2},{"id":"jvasp-85686","created_at":"2022-09-04T14:36:02.609312Z","updated_at":"2022-09-04T14:36:02.609326Z","structure_string":"Na2 Zn1 H4 Se2 O10\n1.0\n5.718319 -0.007489 -1.803163\n-2.683877 6.545901 -1.110686\n-0.083518 0.000340 5.584505\nNa Zn H Se O\n2 1 4 2 10\ndirect\n0.723696 0.247627 0.346428 Na\n0.276303 0.752372 0.653573 Na\n0.000000 0.000000 0.000000 Zn\n0.871276 0.607841 0.853496 H\n0.128723 0.392159 0.146505 H\n0.154422 0.701474 0.078377 H\n0.845577 0.298526 0.921624 H\n0.661036 0.758760 0.324090 Se\n0.338963 0.241240 0.675911 Se\n0.641580 0.371568 0.716348 O\n0.358419 0.628432 0.283653 O\n0.175180 0.389574 0.655124 O\n0.824819 0.610425 0.344877 O\n0.652523 0.862777 0.070823 O\n0.773256 0.954916 0.594958 O\n0.347476 0.137223 0.929177 O\n0.037084 0.727898 0.925720 O\n0.226743 0.045083 0.405042 O\n0.962915 0.272102 0.074280 O\n","nsites":19,"nelements":5,"elements":["Na","Zn","H","Se","O"],"chemical_system":"H-Na-O-Se-Zn","density":3.460433143321408,"density_atomic":0.09137174130133432,"volume":207.94175233390828,"volume_molar":6.590813170715023,"formula_full":"Na2 Zn1 H4 Se2 O10","formula_reduced":"Na2ZnH4(SeO5)2","formula_anonymous":"AB2C2D4E10","energy_above_hull":2.2064184280701755,"spacegroup":2},{"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-12698","created_at":"2022-09-04T14:38:10.675141Z","updated_at":"2022-09-04T14:38:10.675162Z","structure_string":"Ca2 Mn1 P2 H4 O10\n1.0\n5.539257 0.002776 -0.012297\n-1.870724 5.473976 0.002277\n-1.440320 -0.503689 6.404792\nCa Mn P H O\n2 1 2 4 10\ndirect\n0.331552 0.600754 0.233166 Ca\n0.668450 0.399248 0.766834 Ca\n0.000000 0.000000 0.000000 Mn\n0.351278 0.753173 0.766556 P\n0.648723 0.246828 0.233444 P\n0.808950 0.065918 0.562961 H\n0.191052 0.934084 0.437039 H\n0.084395 0.280503 0.658056 H\n0.915607 0.719498 0.341944 H\n0.697521 0.459298 0.400523 O\n0.383940 0.998244 0.669684 O\n0.616062 0.001757 0.330316 O\n0.121010 0.692058 0.881016 O\n0.932925 0.154516 0.698770 O\n0.604104 0.754605 0.931522 O\n0.395898 0.245396 0.068478 O\n0.302480 0.540703 0.599477 O\n0.878991 0.307943 0.118984 O\n0.067077 0.845485 0.301230 O\n","nsites":19,"nelements":5,"elements":["Ca","Mn","P","H","O"],"chemical_system":"Ca-H-Mn-O-P","density":3.088389317251133,"density_atomic":0.09786972133811776,"volume":194.1356298988458,"volume_molar":6.153221525169021,"formula_full":"Ca2 Mn1 P2 H4 O10","formula_reduced":"Ca2MnP2(H2O5)2","formula_anonymous":"AB2C2D4E10","energy_above_hull":2.785262320072595,"spacegroup":2},{"id":"jvasp-99237","created_at":"2022-09-04T14:35:42.745015Z","updated_at":"2022-09-04T14:35:42.745032Z","structure_string":"Ca2 Al4 Si4 H8 O20\n1.0\n2.930471 4.442067 0.000000\n-2.930471 4.442067 0.000000\n0.000000 0.000000 13.231289\nCa Al Si H O\n2 4 4 8 20\ndirect\n0.335752 0.335752 0.250000 Ca\n0.664249 0.664249 0.750000 Ca\n0.000000 0.500000 0.500000 Al\n0.500000 0.000000 0.500000 Al\n0.000000 0.500000 0.000000 Al\n0.500000 0.000000 0.000000 Al\n0.983050 0.983050 0.367198 Si\n0.016951 0.016951 0.632802 Si\n0.983050 0.983050 0.132802 Si\n0.016951 0.016951 0.867198 Si\n0.466739 0.466739 0.934650 H\n0.533262 0.533262 0.065350 H\n0.466739 0.466739 0.565350 H\n0.533262 0.533262 0.434650 H\n0.335849 0.335849 0.812847 H\n0.664152 0.664152 0.187154 H\n0.335849 0.335849 0.687154 H\n0.664152 0.664152 0.312847 H\n0.358047 0.358047 0.947399 O\n0.641954 0.641954 0.052601 O\n0.358047 0.358047 0.552601 O\n0.641954 0.641954 0.447399 O\n0.860155 0.860155 0.935746 O\n0.139845 0.139845 0.064254 O\n0.860155 0.860155 0.564254 O\n0.139845 0.139845 0.435746 O\n0.651583 0.112255 0.115728 O\n0.052212 0.052212 0.250000 O\n0.651583 0.112255 0.384272 O\n0.887746 0.348418 0.615728 O\n0.348418 0.887746 0.884272 O\n0.112255 0.651583 0.115728 O\n0.348418 0.887746 0.615728 O\n0.112255 0.651583 0.384272 O\n0.947788 0.947788 0.750000 O\n0.604165 0.604165 0.250000 O\n0.887746 0.348418 0.884272 O\n0.395836 0.395836 0.750000 O\n","nsites":38,"nelements":5,"elements":["Ca","Al","Si","H","O"],"chemical_system":"Al-Ca-H-O-Si","density":3.0295832172314587,"density_atomic":0.11031356319032173,"volume":344.47260065781194,"volume_molar":5.459111813485821,"formula_full":"Ca2 Al4 Si4 H8 O20","formula_reduced":"CaAl2Si2(H2O5)2","formula_anonymous":"AB2C2D4E10","energy_above_hull":2.7605883273684206,"spacegroup":63},{"id":"jvasp-98162","created_at":"2022-09-04T14:35:45.767111Z","updated_at":"2022-09-04T14:35:45.767128Z","structure_string":"K4 Fe2 H8 S4 O20\n1.0\n6.782686 -0.033474 -2.503118\n-2.280643 9.986121 -3.505594\n0.016268 -0.015202 6.459380\nK Fe H S O\n4 2 8 4 20\ndirect\n0.746433 0.900899 0.189104 K\n0.253569 0.099101 0.810897 K\n0.238118 0.575496 0.812831 K\n0.761883 0.424505 0.187170 K\n0.473038 0.750054 0.498506 Fe\n0.526964 0.249947 0.501495 Fe\n0.073624 0.714062 0.369484 H\n0.827894 0.205161 0.343863 H\n0.172108 0.794840 0.656138 H\n0.926378 0.285938 0.630517 H\n0.820301 0.700834 0.562855 H\n0.151219 0.141622 0.375400 H\n0.848783 0.858379 0.624601 H\n0.179700 0.299166 0.437146 H\n0.273261 0.924948 0.173206 S\n0.726741 0.075053 0.826795 S\n0.728983 0.584136 0.813467 S\n0.271018 0.415865 0.186534 S\n0.165309 0.428756 0.350864 O\n0.875004 0.636081 0.064068 O\n0.124998 0.363919 0.935933 O\n0.229472 0.230171 0.500372 O\n0.400160 0.548921 0.243551 O\n0.770529 0.769830 0.499629 O\n0.834693 0.571245 0.649137 O\n0.599841 0.451080 0.756450 O\n0.409315 0.320404 0.217428 O\n0.433729 0.045925 0.237917 O\n0.622670 0.185171 0.787995 O\n0.377332 0.814829 0.212006 O\n0.846079 0.041783 0.679027 O\n0.153922 0.958217 0.320974 O\n0.858364 0.121344 0.084559 O\n0.141638 0.878657 0.915442 O\n0.566272 0.954075 0.762084 O\n0.189384 0.729367 0.518712 O\n0.590686 0.679597 0.782573 O\n0.810618 0.270634 0.481289 O\n","nsites":38,"nelements":5,"elements":["K","Fe","H","S","O"],"chemical_system":"Fe-H-K-O-S","density":2.7527338743840333,"density_atomic":0.086960784741695,"volume":436.97857733084805,"volume_molar":6.925122373133979,"formula_full":"K4 Fe2 H8 S4 O20","formula_reduced":"K2FeH4(SO5)2","formula_anonymous":"AB2C2D4E10","energy_above_hull":2.5608471842105263,"spacegroup":2}]}